3-[(4-methoxyphenyl)methyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
3-[(4-methoxyphenyl)methyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | E754-0618 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C22 H21 N O4 |
| Smiles: | COc1ccc(CN2Cc3c(ccc4C5CCCC=5C(=O)Oc34)OC2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7849 |
| logD: | 3.6816 |
| logSw: | -4.1028 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.259 |
| InChI Key: | IDQSVJCFEDTPPX-UHFFFAOYSA-N |