N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0304 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 401.82 |
| Molecular Formula: | C20 H17 Cl F N3 O3 |
| Smiles: | C1CCN(C1)C1=C(C(=O)Oc2ccccc12)NC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5506 |
| logD: | 4.4553 |
| logSw: | -4.7689 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.399 |
| InChI Key: | IYZVYFGDVADCKO-UHFFFAOYSA-N |