200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 1370411-44-1

1370411-44-1

1370411-44-1 | Pyrido[3,4-d]pyrimidine-7(6H)-carboxylic acid, 2,4-dichloro-5,8-dihydro-, phenylmethyl ester

CAS No: 1370411-44-1 Catalog No: AG0012QP MDL No:MFCD19707615

Product Description

Catalog Number:
AG0012QP
Chemical Name:
Pyrido[3,4-d]pyrimidine-7(6H)-carboxylic acid, 2,4-dichloro-5,8-dihydro-, phenylmethyl ester
CAS Number:
1370411-44-1
Molecular Formula:
C15H13Cl2N3O2
Molecular Weight:
338.1886
MDL Number:
MFCD19707615
IUPAC Name:
benzyl 2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate
InChI:
InChI=1S/C15H13Cl2N3O2/c16-13-11-6-7-20(8-12(11)18-14(17)19-13)15(21)22-9-10-4-2-1-3-5-10/h1-5H,6-9H2
InChI Key:
XLMNHZAOTDBGMV-UHFFFAOYSA-N
SMILES:
Clc1nc2CN(CCc2c(n1)Cl)C(=O)OCc1ccccc1

Properties

Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.038g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.188g/mol
Monoisotopic Mass:
337.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

© 2019 Angene International Limited. All rights Reserved.