4-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}-2-methoxyphenyl 4-methoxybenzoate
Chemical Structure Depiction of
4-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}-2-methoxyphenyl 4-methoxybenzoate
4-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}-2-methoxyphenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 6313-0038 |
| Compound Name: | 4-{[(4-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]methyl}-2-methoxyphenyl 4-methoxybenzoate |
| Molecular Weight: | 563.03 |
| Molecular Formula: | C29 H23 Cl N2 O6 S |
| Smiles: | COc1ccc(cc1)C(=O)Oc1ccc(CN(C2c3ccccc3S(N=2)(=O)=O)c2ccc(cc2)[Cl])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.8094 |
| logD: | 5.8094 |
| logSw: | -5.9143 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.472 |
| InChI Key: | MEAUCCCABYBCFA-UHFFFAOYSA-N |