4-{[3-(3-chlorophenyl)-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene](cyano)acetyl}-N-(propan-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-{[3-(3-chlorophenyl)-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene](cyano)acetyl}-N-(propan-2-yl)piperazine-1-carboxamide
4-{[3-(3-chlorophenyl)-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene](cyano)acetyl}-N-(propan-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V025-6887 |
| Compound Name: | 4-{[3-(3-chlorophenyl)-4-(4-fluorophenyl)-1,3-thiazol-2(3H)-ylidene](cyano)acetyl}-N-(propan-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 526.03 |
| Molecular Formula: | C26 H25 Cl F N5 O2 S |
| Smiles: | CC(C)NC(N1CCN(CC1)C(C(/C#N)=C1/N(C(=CS1)c1ccc(cc1)F)c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7231 |
| logD: | 4.7231 |
| logSw: | -4.8535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.536 |
| InChI Key: | SRNNMQZPGPGNRM-UHFFFAOYSA-N |