12-chloro-3-[4-(propan-2-yl)phenyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
12-chloro-3-[4-(propan-2-yl)phenyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
12-chloro-3-[4-(propan-2-yl)phenyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | Y040-7565 |
| Compound Name: | 12-chloro-3-[4-(propan-2-yl)phenyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 409.91 |
| Molecular Formula: | C24 H24 Cl N O3 |
| Smiles: | CC(C)c1ccc(cc1)N1Cc2c3c(cc(c2OC1)[Cl])C1CCCCC=1C(=O)O3 |
| Stereo: | ACHIRAL |
| logP: | 7.2021 |
| logD: | 7.2021 |
| logSw: | -6.5031 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.754 |
| InChI Key: | KYJMQMYZEXMXTA-UHFFFAOYSA-N |