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1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione structure

CAS No:
132101-22-5
Formula:
C11H13N3O4
Chemical Name:
1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Synonyms:
5'-isocyano-5'-deoxythymidine;5-ICDT;5'-Isocyano-5'-deoxythymidine;5'-Deoxy-5'-isocyanothymidine;132101-22-5;Thymidine, 5'-deoxy-5'-isocyano-;5-Icdt;5'-IsocyanoT deriv.;DTXSID40927540;1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione;1-(2,5-Dideoxy-5-isocyanopentofuranosyl)-4-hydroxy-5-methylpyrimidin-2(1H)-one;1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione

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1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Basic Attributes

Molecular Weight：

251.24 g/mol

Exact Mass：

251.09060590 g/mol

Characteristics

PSA：

83.2 Å²

Drug Information

MeSH Entry Terms：

5'-isocyano-5'-deoxythymidine

Computed Properties

Molecular Weight:251.24
XLogP3:-1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:251.09060590
Monoisotopic Mass:251.09060590
Topological Polar Surface Area:83.2
Heavy Atom Count:18
Complexity:464
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(2R,4S,5R)-4-hydroxy-5-(isocyanomethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Basic Attributes
Characteristics
Drug Information
Computed Properties

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