3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | D144-0385 |
| Compound Name: | 3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 391.85 |
| Molecular Formula: | C23 H18 Cl N O3 |
| Smiles: | C(CN1Cc2c(ccc3c4ccccc4C(=O)Oc23)OC1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.878 |
| logD: | 4.8281 |
| logSw: | -5.0572 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.136 |
| InChI Key: | UQRVGWUOEYCASE-UHFFFAOYSA-N |