3-(3-chloro-4-methylphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
3-(3-chloro-4-methylphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
3-(3-chloro-4-methylphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | Y040-7557 |
| Compound Name: | 3-(3-chloro-4-methylphenyl)-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 367.83 |
| Molecular Formula: | C21 H18 Cl N O3 |
| Smiles: | Cc1ccc(cc1[Cl])N1Cc2c(ccc3C4CCCC=4C(=O)Oc23)OC1 |
| Stereo: | ACHIRAL |
| logP: | 5.2312 |
| logD: | 5.2312 |
| logSw: | -5.5699 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.435 |
| InChI Key: | LHJUHCRREPEUJX-UHFFFAOYSA-N |