methyl 2-({2-[(methanesulfonyl)amino]-1,3-benzothiazol-6-yl}carbamamido)-4-methylbenzoate
Chemical Structure Depiction of
methyl 2-({2-[(methanesulfonyl)amino]-1,3-benzothiazol-6-yl}carbamamido)-4-methylbenzoate
methyl 2-({2-[(methanesulfonyl)amino]-1,3-benzothiazol-6-yl}carbamamido)-4-methylbenzoate
Compound characteristics
| Compound ID: | L366-0091 |
| Compound Name: | methyl 2-({2-[(methanesulfonyl)amino]-1,3-benzothiazol-6-yl}carbamamido)-4-methylbenzoate |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C18 H18 N4 O5 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(C)(=O)=O)s2)NC(Nc1cc(C)ccc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3537 |
| logD: | 3.2219 |
| logSw: | -3.6872 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.646 |
| InChI Key: | GHBVDNQPBRLMQU-UHFFFAOYSA-N |