N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-benzyl-2-(5-chloro-2-methylanilino)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-benzyl-2-(5-chloro-2-methylanilino)-1,3-thiazole-4-carboxamide
N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-benzyl-2-(5-chloro-2-methylanilino)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V027-4673 |
| Compound Name: | N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-N-benzyl-2-(5-chloro-2-methylanilino)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 540.08 |
| Molecular Formula: | C27 H30 Cl N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(CCN(Cc1ccccc1)C(c1csc(Nc2cc(ccc2C)[Cl])n1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8083 |
| logD: | 3.8083 |
| logSw: | -4.2815 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.005 |
| InChI Key: | SJHQYQPVURHRRR-UHFFFAOYSA-N |