2-amino-1-(3-chlorophenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(3-chlorophenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
2-amino-1-(3-chlorophenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Compound characteristics
| Compound ID: | 8018-8688 |
| Compound Name: | 2-amino-1-(3-chlorophenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile |
| Molecular Weight: | 245.71 |
| Molecular Formula: | C13 H12 Cl N3 |
| Smiles: | Cc1c(C#N)c(N)n(c2cccc(c2)[Cl])c1C |
| Stereo: | ACHIRAL |
| logP: | 2.9061 |
| logD: | 2.9061 |
| logSw: | -3.6603 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.986 |
| InChI Key: | LAICMSHWIXBOHV-UHFFFAOYSA-N |