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4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide

4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide structure

CAS No:
20201-56-3
Formula:
C12H14BrN5O5
Chemical Name:
4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide
Synonyms:
6-Bromosangivamycin; 6-Bromsangivamycin;

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4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide Basic Attributes

Molecular Weight：

388.17400

Exact Mass：

387.01783 g/mol

NSC Number：

113943

Characteristics

PSA：

169.74000

XLogP3：

-0.23210

Density：

2.39g/cm3

Boiling Point：

788.8ºC at 760 mmHg

Flash Point：

430.9ºC

Refractive Index：

1.916

Vapor Pressure：

3.2E-26mmHg at 25°C

Computed Properties

Molecular Weight:388.17
XLogP3:-1.4
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:387.01783
Monoisotopic Mass:387.01783
Topological Polar Surface Area:170
Heavy Atom Count:23
Complexity:473
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide

Basic Attributes
Characteristics
Computed Properties

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