2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl 4-methylbenzoate
Chemical Structure Depiction of
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl 4-methylbenzoate
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 6313-0007 |
| Compound Name: | 2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl 4-methylbenzoate |
| Molecular Weight: | 434.51 |
| Molecular Formula: | C24 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1)C(=O)OCCN(C1c2ccccc2S(N=1)(=O)=O)c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2496 |
| logD: | 5.2496 |
| logSw: | -5.0546 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.859 |
| InChI Key: | GYKMAJGOFJBCCP-UHFFFAOYSA-N |