200,000+ products from a single source!
sales@angenechem.com
132336-37-9 | Phosphonic acid, P-[[(1S)-2-[4-(benzoylamino)-2-oxo-1(2H)-pyrimidinyl]-1-(hydroxymethyl)ethoxy]methyl]-
CAS No: 132336-37-9 Catalog No: AG0010JN MDL No:MFCD23135282
Product Description
Catalog Number:
AG0010JN
Chemical Name:
Phosphonic acid, P-[[(1S)-2-[4-(benzoylamino)-2-oxo-1(2H)-pyrimidinyl]-1-(hydroxymethyl)ethoxy]methyl]-
CAS Number:
132336-37-9
Molecular Formula:
C15H18N3O7P
Molecular Weight:
383.2931
MDL Number:
MFCD23135282
IUPAC Name:
[(2S)-1-(4-benzamido-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid
InChI:
InChI=1S/C15H18N3O7P/c19-9-12(25-10-26(22,23)24)8-18-7-6-13(17-15(18)21)16-14(20)11-4-2-1-3-5-11/h1-7,12,19H,8-10H2,(H2,22,23,24)(H,16,17,20,21)/t12-/m0/s1
InChI Key:
OLNRVCCBVZSXBX-LBPRGKRZSA-N
SMILES:
OC[C@H](Cn1ccc(nc1=O)NC(=O)c1ccccc1)OCP(=O)(O)O
Properties
Complexity:
625
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
383.088g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
383.297g/mol
Monoisotopic Mass:
383.088g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
149A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.