N-ethyl-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Chemical Structure Depiction of
N-ethyl-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
N-ethyl-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea
Compound characteristics
| Compound ID: | M072-0437 |
| Compound Name: | N-ethyl-N'-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]urea |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C13 H17 N3 O3 S2 |
| Smiles: | CCNC(Nc1ccc2c(c1)sc(n2)S(C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7221 |
| logD: | 2.7221 |
| logSw: | -3.3588 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.029 |
| InChI Key: | JMACWDODCYKQHN-UHFFFAOYSA-N |