N-(3-chloro-4-methylphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
N-(3-chloro-4-methylphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0005 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-N'-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 357.79 |
| Molecular Formula: | C18 H16 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1[Cl])NC(NC1=C(c2ccccc2OC1=O)NC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8986 |
| logD: | 3.8663 |
| logSw: | -4.3878 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.518 |
| InChI Key: | SPLIZYCPMZRGFJ-UHFFFAOYSA-N |