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2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE

2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE structure

CAS No:
133040-77-4
Formula:
C27H24BrN3O2
Chemical Name:
2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE
Synonyms:
LY 225910;2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE;2-(2-(5-Bromo-(1H)-indol-3-yl)ethyl)-3-(3-(1-methylethoxy)phenyl)-4-(3H)-quinazoline;2-(2-(5-BroMo-1H-indol-3-yl)ethyl)-3-(3-isopropoxyphenyl)quinazolin-4(3H)-one;2-[2-(5-Bromo-1H-indol-3-yl)-ethyl]-3-(3-isopropoxy-phenyl)-3H-quinazolin-4-one

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Description

2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)-4-quinazolinone is a member of quinazolines.

2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE Basic Attributes

Molecular Weight：

502.4

Exact Mass：

501.10500

Characteristics

PSA：

57.7

XLogP3：

6.20190

Appearance：

off-white

Density：

1.39g/cm3

Boiling Point：

690.3ºC at 760mmHg

Flash Point：

337 - 405℃

Refractive Index：

1.667

Water Solubility：

DMSO: >20mg/mL

Storage Conditions：

Desiccate at -20°C

Safety Information

Transport codes：

UN 2811 6.1 / PGIII

wgk germany：

hazard class code：

Marks：

Precautionary statement(s)：

P301 + P310

Hazard Statements：

H301-H413

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P273, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-(2-(5-bromo-1H-indol-3-yl)ethyl)-3-(1-methylethoxyphenyl)-4-(3H)-quinazolinone

2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE Use and Manufacturing

Potent CCK 2 receptor antagonist (IC 50 = 9.3 nM for inhibition of 125 I-labeled CCK-8 sulfate binding at mouse brain membranes).

Computed Properties

Molecular Weight:502.4
XLogP3:5.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:501.10519
Monoisotopic Mass:501.10519
Topological Polar Surface Area:57.7
Heavy Atom Count:33
Complexity:728
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE

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

2-[2-(5-BROMO-1H-INDOL-3-YL)ETHYL]-3-[3-(1-METHYLETHOXY)PHENYL]-4-(3H)-QUINAZOLINONE

SDS

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