N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-4-methylbenzamide
N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | 4292-0516 |
| Compound Name: | N-[3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-4-methylbenzamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | Cc1ccc(cc1)C(NC(=C/c1cccs1)\C(NCCCn1ccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2731 |
| logD: | 1.9622 |
| logSw: | -2.6769 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.237 |
| InChI Key: | ONNGMJFWRKIKGK-UHFFFAOYSA-N |