2-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}phenyl 2-methylbenzoate
Chemical Structure Depiction of
2-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}phenyl 2-methylbenzoate
2-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}phenyl 2-methylbenzoate
Compound characteristics
| Compound ID: | 6313-0033 |
| Compound Name: | 2-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}phenyl 2-methylbenzoate |
| Molecular Weight: | 517 |
| Molecular Formula: | C28 H21 Cl N2 O4 S |
| Smiles: | Cc1ccccc1C(=O)Oc1ccccc1CN(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.4997 |
| logD: | 6.4997 |
| logSw: | -6.1361 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.298 |
| InChI Key: | MKEUBPHDEWJCOT-UHFFFAOYSA-N |