2-chloro-N-{3-[(2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
Chemical Structure Depiction of
2-chloro-N-{3-[(2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
2-chloro-N-{3-[(2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-benzothiazol-2(3H)-ylidene}benzamide
Compound characteristics
| Compound ID: | V027-4629 |
| Compound Name: | 2-chloro-N-{3-[(2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-benzothiazol-2(3H)-ylidene}benzamide |
| Molecular Weight: | 530.02 |
| Molecular Formula: | C29 H21 Cl F N3 O2 S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)NC(c1ccccc1CN1/C(=N/C(c2ccccc2[Cl])=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0505 |
| logD: | 6.0498 |
| logSw: | -6.0164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.672 |
| InChI Key: | RQFVGCITVUBGGM-UHFFFAOYSA-N |