N-(2-{[(3-chlorophenyl)carbamothioyl]amino}ethyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2-{[(3-chlorophenyl)carbamothioyl]amino}ethyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
N-(2-{[(3-chlorophenyl)carbamothioyl]amino}ethyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y503-4654 |
| Compound Name: | N-(2-{[(3-chlorophenyl)carbamothioyl]amino}ethyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 351.86 |
| Molecular Formula: | C15 H18 Cl N5 O S |
| Smiles: | Cc1cc(C(NCCNC(Nc2cccc(c2)[Cl])=S)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 1.7017 |
| logD: | 1.7017 |
| logSw: | -2.7916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.237 |
| InChI Key: | MPBYEJWAUAWZFA-UHFFFAOYSA-N |