methyl 4-{[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]carbamamido}benzoate
methyl 4-{[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | L320-0343 |
| Compound Name: | methyl 4-{[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]carbamamido}benzoate |
| Molecular Weight: | 437.9 |
| Molecular Formula: | C22 H16 Cl N3 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(Nc1ccc(c(c1)[Cl])c1nc2ccccc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5316 |
| logD: | 6.5315 |
| logSw: | -6.2897 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.164 |
| InChI Key: | AWNYAHGHCQEHLP-UHFFFAOYSA-N |