N-benzyl-5-chloro-N-[(furan-2-yl)methyl]-2-(methanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-5-chloro-N-[(furan-2-yl)methyl]-2-(methanesulfonyl)pyrimidine-4-carboxamide
N-benzyl-5-chloro-N-[(furan-2-yl)methyl]-2-(methanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D053-0303 |
Compound Name: | N-benzyl-5-chloro-N-[(furan-2-yl)methyl]-2-(methanesulfonyl)pyrimidine-4-carboxamide |
Molecular Weight: | 405.86 |
Molecular Formula: | C18 H16 Cl N3 O4 S |
Smiles: | CS(c1ncc(c(C(N(Cc2ccccc2)Cc2ccco2)=O)n1)[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.3251 |
logD: | 2.3251 |
logSw: | -2.8703 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 73.089 |
InChI Key: | GDPNYNQDBKZETO-UHFFFAOYSA-N |