N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3-(4-methylphenyl)-2,1-benzoxazole-5-carboxamide
Chemical Structure Depiction of
N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3-(4-methylphenyl)-2,1-benzoxazole-5-carboxamide
N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3-(4-methylphenyl)-2,1-benzoxazole-5-carboxamide
Compound characteristics
| Compound ID: | C301-8082 |
| Compound Name: | N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-3-(4-methylphenyl)-2,1-benzoxazole-5-carboxamide |
| Molecular Weight: | 474.99 |
| Molecular Formula: | C27 H27 Cl N4 O2 |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1[Cl])NC(c1ccc2c(c1)c(c1ccc(C)cc1)on2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2401 |
| logD: | 5.9229 |
| logSw: | -6.2447 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.501 |
| InChI Key: | BDDUOEJMBFFBQN-UHFFFAOYSA-N |