11-chloro-3-[2-(4-methoxyphenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
11-chloro-3-[2-(4-methoxyphenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
11-chloro-3-[2-(4-methoxyphenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | D144-0401 |
| Compound Name: | 11-chloro-3-[2-(4-methoxyphenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 411.88 |
| Molecular Formula: | C23 H22 Cl N O4 |
| Smiles: | COc1ccc(CCN2Cc3c4c(cc(c3OC2)[Cl])C2CCCC=2C(=O)O4)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8781 |
| logD: | 4.7267 |
| logSw: | -4.9685 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.922 |
| InChI Key: | JIZWDOVQWARSSR-UHFFFAOYSA-N |