 Home > Encyclopedia > 2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile structure

CAS No:
127945-67-9
Formula:
C12H15N5O4S
Chemical Name:
2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

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2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Basic Attributes

Molecular Weight：

325.34400

Exact Mass：

325.08447515

DSSTox ID：

DTXSID10155737

Characteristics

PSA：

176.47000

XLogP3：

-0.42992

Density：

1.67g/cm3

Boiling Point：

691.3ºC at 760mmHg

Flash Point：

371.9ºC

Refractive Index：

1.736

Vapor Pressure：

4.59E-20mmHg at 25°C

Computed Properties

Molecular Weight:325.35
XLogP3:-1.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:325.08447515
Monoisotopic Mass:325.08447515
Topological Polar Surface Area:171
Heavy Atom Count:22
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-amino-7-(1,3-dihydroxypropan-2-yloxymethyl)-6-methylsulfanyl-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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