2-chloro-N-[3-({4-[(propan-2-yl)carbamoyl]phenyl}methyl)-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
2-chloro-N-[3-({4-[(propan-2-yl)carbamoyl]phenyl}methyl)-1,3-thiazol-2(3H)-ylidene]benzamide
2-chloro-N-[3-({4-[(propan-2-yl)carbamoyl]phenyl}methyl)-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V021-7468 |
| Compound Name: | 2-chloro-N-[3-({4-[(propan-2-yl)carbamoyl]phenyl}methyl)-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 413.92 |
| Molecular Formula: | C21 H20 Cl N3 O2 S |
| Smiles: | CC(C)NC(c1ccc(CN2C=CSC/2=N/C(c2ccccc2[Cl])=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9316 |
| logD: | 2.9316 |
| logSw: | -3.7832 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.529 |
| InChI Key: | LSHSEMVRINJZGC-FLFQWRMESA-N |