N-(1,3-benzothiazol-2-yl)-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-N'-[3-(methylsulfanyl)phenyl]urea
N-(1,3-benzothiazol-2-yl)-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | D408-0693 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 315.41 |
| Molecular Formula: | C15 H13 N3 O S2 |
| Smiles: | CSc1cccc(c1)NC(Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8387 |
| logD: | 4.8387 |
| logSw: | -4.65 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.303 |
| InChI Key: | XNRHEWCKNVNNJT-UHFFFAOYSA-N |