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(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine

(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine structure

CAS No:
132746-60-2
Formula:
C28H32N2O
Chemical Name:
(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
Synonyms:
1-Azabicyclo[2.2.2]octan-3-amine,2-(diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-,(2S,3S)-;1-Azabicyclo[2.2.2]octan-3-amine,2-(diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-,(2S-cis)-;(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine;CP 96345

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(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine Basic Attributes

Molecular Weight：

412.574

Exact Mass：

412.57

UNII：

W22ILA2I52

Characteristics

PSA：

24.5

XLogP3：

5.4

Water Solubility：

DMSO: soluble24mg/mL

Storage Conditions：

Store at -20°C

Safety Information

Transport codes：

UN 3077 9 / PGIII

wgk germany：

hazard class code：

22-36/37/38-50/53

safety instructions：

26-60-61

Marks：

Xn,N

Precautionary statement(s)：

P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501

Hazard Statements：

H302

Drug Information

MeSH：

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions.They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)|Drugs used to induce drowsiness or sleep or to reduce psychological excitement or anxiety. (See all compounds classified as Hypnotics and Sedatives.)

MeSH Entry Terms：

2-(diphenylmethyl)-N-((2-methoxyphenyl)methyl)-1-azabicyclo(2.2.2)octan-3-amine

(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine Use and Manufacturing

CP 96345 is a potent and selective non-peptide NK1 receptor antagonist. CP 96345 attenuates substance P-induced salivary response and inhibits neurogenic inflammation in vivo.

Computed Properties

Molecular Weight:412.6
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:412.251463648
Monoisotopic Mass:412.251463648
Topological Polar Surface Area:24.5
Heavy Atom Count:31
Complexity:515
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties

(2S,3S)-2-(Diphenylmethyl)-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine

SDS

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