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9-deaza-9-(3-thienylmethyl)guanine

9-deaza-9-(3-thienylmethyl)guanine structure

CAS No:
132138-76-2
Formula:
C11H10N4OS
Chemical Name:
9-deaza-9-(3-thienylmethyl)guanine
Synonyms:
9-deaza-9-(3-thienylmethyl)guanine;CI 1000;CI-1000;PD 141955;PD-141955;UNII-TK5264YUH3;CHEMBL79784;TK5264YUH3

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9-deaza-9-(3-thienylmethyl)guanine Basic Attributes

Molecular Weight：

246.293

Exact Mass：

246.058

UNII：

TK5264YUH3

DSSTox ID：

DTXSID00157366

Characteristics

PSA：

112

XLogP3：

0.8

Density：

1.67g/cm3

Boiling Point：

512.3ºC at 760 mmHg

Flash Point：

263.6ºC

Refractive Index：

1.844

Vapor Pressure：

1.31E-10mmHg at 25°C

Drug Information

MeSH Entry Terms：

9-deaza-9-(3-thienylmethyl)guanine

Computed Properties

Molecular Weight:246.29
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:246.05753213
Monoisotopic Mass:246.05753213
Topological Polar Surface Area:112
Heavy Atom Count:17
Complexity:359
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-deaza-9-(3-thienylmethyl)guanine

Basic Attributes
Characteristics
Drug Information
Computed Properties

9-deaza-9-(3-thienylmethyl)guanine

SDS

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