4-acetyl-N-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-acetyl-N-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
4-acetyl-N-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | C444-0545 |
| Compound Name: | 4-acetyl-N-[(4-chlorophenyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 304.77 |
| Molecular Formula: | C16 H17 Cl N2 O2 |
| Smiles: | CC(c1c(C)c(C(NCc2ccc(cc2)[Cl])=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8651 |
| logD: | 2.8651 |
| logSw: | -3.6796 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.46 |
| InChI Key: | XBPMJXOMZZJYMA-UHFFFAOYSA-N |