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(6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate

(6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate structure

CAS No:
103926-64-3
Formula:
C21H19N5O2
Chemical Name:
(6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate
Synonyms:
Sepimostat; Sepimostat [INN]; UNII-5ZFR16F4QQ;

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(6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate Basic Attributes

Molecular Weight：

373.40800

Exact Mass：

373.15387487 g/mol

UNII：

5ZFR16F4QQ

DSSTox ID：

DTXSID50146144

Characteristics

PSA：

112.59000

XLogP3：

3.35160

Density：

1.39g/cm3

Boiling Point：

607.4ºC

Flash Point：

321.2ºC

Refractive Index：

1.707

Vapor Pressure：

1.06E-14mmHg at 25°C

Drug Information

MeSH：

Compounds which inhibit or antagonize biosynthesis or actions of proteases (ENDOPEPTIDASES). (See all compounds classified as Protease Inhibitors.)

MeSH Entry Terms：

6-amidino-2-naphthyl-(4-(4,5-dihydro-1H-imidazol-2-yl)amino)benzoate dimethanesulfonate

Computed Properties

Molecular Weight:373.4
XLogP3:2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:373.15387487
Monoisotopic Mass:373.15387487
Topological Polar Surface Area:113
Heavy Atom Count:28
Complexity:614
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate

Basic Attributes
Characteristics
Drug Information
Computed Properties

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