N-[(4-chlorophenyl)methyl]-1-methyl-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-1-methyl-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide
N-[(4-chlorophenyl)methyl]-1-methyl-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide
Compound characteristics
Compound ID: | P076-0246 |
Compound Name: | N-[(4-chlorophenyl)methyl]-1-methyl-4-(pyridin-4-yl)-1H-pyrrole-2-carboxamide |
Molecular Weight: | 325.8 |
Molecular Formula: | C18 H16 Cl N3 O |
Smiles: | Cn1cc(cc1C(NCc1ccc(cc1)[Cl])=O)c1ccncc1 |
Stereo: | ACHIRAL |
logP: | 3.2284 |
logD: | 3.2235 |
logSw: | -3.777 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 36.118 |
InChI Key: | XVHDSHVZXKZETO-UHFFFAOYSA-N |