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4-amino-1-[(4R,5S)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyridin-2-one

4-amino-1-[(4R,5S)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyridin-2-one structure

CAS No:
130378-88-0
Formula:
C11H14N2O4
Chemical Name:
4-amino-1-[(4R,5S)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyridin-2-one
Synonyms:
3-Deaza-cpe-C; Cyclopentenyl-3-deazacytidine;

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4-amino-1-[(4R,5S)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyridin-2-one Basic Attributes

Molecular Weight：

238.24000

Exact Mass：

238.09535693 g/mol

Characteristics

PSA：

108.71000

XLogP3：

-0.79310

Density：

1.563g/cm3

Boiling Point：

516.6ºC

Flash Point：

266.3ºC

Refractive Index：

1.711

Vapor Pressure：

7.8E-13mmHg at 25°C

Drug Information

MeSH Entry Terms：

1-(3-(hydroxymethyl)-(4,5-dihydroxy)-2-cyclpenten-1-yl)-4-amino-2-pyridone

Computed Properties

Molecular Weight:238.24
XLogP3:-1.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:238.09535693
Monoisotopic Mass:238.09535693
Topological Polar Surface Area:107
Heavy Atom Count:17
Complexity:427
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon tetrabromide; methyl ethyl ketoxime; sodium tripolyphosphate; benzaldehyde molar mass; benzyl acetate; cefipime

Guide of 4-amino-1-[(4R,5S)-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyridin-2-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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