N-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]-N'-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]-N'-[(oxolan-2-yl)methyl]urea
N-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]-N'-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | M072-0592 |
| Compound Name: | N-[2-(2-methylpropane-1-sulfonyl)-1,3-benzothiazol-6-yl]-N'-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C17 H23 N3 O4 S2 |
| Smiles: | CC(C)CS(c1nc2ccc(cc2s1)NC(NCC1CCCO1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9934 |
| logD: | 2.9934 |
| logSw: | -3.5145 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.049 |
| InChI Key: | MDINMLJZTZPAMB-CYBMUJFWSA-N |