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(5S)-8-chloro-5-(2,3-dihydro-1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol

(5S)-8-chloro-5-(2,3-dihydro-1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol structure

CAS No:
131796-63-9
Formula:
C19H20ClNO2
Chemical Name:
(5S)-8-chloro-5-(2,3-dihydro-1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol
Synonyms:
UNII-847PQF7ZN6; Nnc 756; Odapipam;

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(5S)-8-chloro-5-(2,3-dihydro-1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Basic Attributes

Molecular Weight：

329.82100

Exact Mass：

329.1182566 g/mol

UNII：

847PQF7ZN6

DSSTox ID：

DTXSID50157210

HScode：

2934999090

Characteristics

PSA：

32.70000

XLogP3：

3.53820

Density：

1.269g/cm3

Boiling Point：

460.4ºC at 760mmHg

Flash Point：

232.2ºC

Refractive Index：

1.623

Vapor Pressure：

4.27E-09mmHg at 25°C

Drug Information

MeSH Entry Terms：

(+)-(S)-8-chloro-5-(2,3-dihydro-7-benzofuranyl)-2,3,4,5-tetrahydro-3-methyl-1h-3-benzazepin-7-ol

Computed Properties

Molecular Weight:329.8
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:329.1182566
Monoisotopic Mass:329.1182566
Topological Polar Surface Area:32.7
Heavy Atom Count:23
Complexity:420
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (5S)-8-chloro-5-(2,3-dihydro-1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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