4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3,4,5-trimethoxybenzoate
4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | 6313-0013 |
| Compound Name: | 4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 588.64 |
| Molecular Formula: | C31 H28 N2 O8 S |
| Smiles: | COc1ccc(CN(C2c3ccccc3S(N=2)(=O)=O)c2ccc(cc2)OC(c2cc(c(c(c2)OC)OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7102 |
| logD: | 4.7102 |
| logSw: | -4.582 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.733 |
| InChI Key: | OUCSZEDBLHCLCO-UHFFFAOYSA-N |