Name: Name:Carbamic acid,[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]-, phenylmethyl ester
Brand: Angene
SKU: AG00I99L
Rating: 90 (10 reviews)

Carbamic acid,[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]-, phenylmethyl ester

CAS No.:

518048-02-7

Catalog Number:

AG00I99L

Molecular Formula:

C24H25FN4O5

Molecular Weight:

468.4775

Catalog Number:

AG00I99L

Chemical Name:

Carbamic acid,[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]-, phenylmethyl ester

CAS Number:

518048-02-7

Molecular Formula:

C24H25FN4O5

Molecular Weight:

468.4775

MDL Number:

MFCD10698740

IUPAC Name:

benzyl N-[2-[4-[(4-fluorophenyl)methylcarbamoyl]-5-hydroxy-1-methyl-6-oxopyrimidin-2-yl]propan-2-yl]carbamate

InChI:

InChI=1S/C24H25FN4O5/c1-24(2,28-23(33)34-14-16-7-5-4-6-8-16)22-27-18(19(30)21(32)29(22)3)20(31)26-13-15-9-11-17(25)12-10-15/h4-12,30H,13-14H2,1-3H3,(H,26,31)(H,28,33)

InChI Key:

YSQDMQRPJOGQNV-UHFFFAOYSA-N

SMILES:

O=C(NC(c1nc(C(=O)NCc2ccc(cc2)F)c(c(=O)n1C)O)(C)C)OCc1ccccc1

EC Number:

610-732-8

Complexity:

842

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

468.181g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

468.485g/mol

Monoisotopic Mass:

468.181g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

120A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8