N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea
Compound characteristics
| Compound ID: | F129-0331 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]urea |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C22 H21 N3 O5 |
| Smiles: | C1CCN(C1)C1=C(C(=O)Oc2ccccc12)NC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.793 |
| logD: | 2.7835 |
| logSw: | -3.5592 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.222 |
| InChI Key: | YAXAVDDSMDCTRF-UHFFFAOYSA-N |