N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-[3-(methylsulfanyl)phenyl]urea
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | F129-0058 |
| Compound Name: | N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C18 H17 N3 O3 S |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9693 |
| logD: | 2.9626 |
| logSw: | -3.6032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.518 |
| InChI Key: | COYIRRRPKHQQHE-UHFFFAOYSA-N |