3-[(4-methylphenyl)methyl]-3,4,8,9,10,11-hexahydro-2H-cyclohepta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-3,4,8,9,10,11-hexahydro-2H-cyclohepta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
3-[(4-methylphenyl)methyl]-3,4,8,9,10,11-hexahydro-2H-cyclohepta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | D144-0047 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-3,4,8,9,10,11-hexahydro-2H-cyclohepta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C24 H25 N O3 |
| Smiles: | Cc1ccc(CN2Cc3c(ccc4C5CCCCCC=5C(=O)Oc34)OC2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5191 |
| logD: | 5.0876 |
| logSw: | -5.2434 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.68 |
| InChI Key: | OFKQJVZQSQYZAL-UHFFFAOYSA-N |