N-(2-methoxy-4-nitrophenyl)-N'-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)urea
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-N'-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)urea
N-(2-methoxy-4-nitrophenyl)-N'-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)urea
Compound characteristics
| Compound ID: | Y205-3018 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-N'-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)urea |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C15 H16 N4 O4 S |
| Smiles: | COc1cc(ccc1NC(Nc1nc2CCCCc2s1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0832 |
| logD: | 4.0744 |
| logSw: | -4.2974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.323 |
| InChI Key: | HTQWUSIKDXZDEH-UHFFFAOYSA-N |