N-[(3-methoxyphenyl)methyl]-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
N-[(3-methoxyphenyl)methyl]-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0333 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C22 H23 N3 O4 |
| Smiles: | COc1cccc(CNC(NC2=C(c3ccccc3OC2=O)N2CCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1342 |
| logD: | 3.1165 |
| logSw: | -3.6036 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.265 |
| InChI Key: | CBMALBWYEXPYLQ-UHFFFAOYSA-N |