4,4,6a,6b-tetramethyl-3-phenylhexahydro-2H,3H-1-oxa-2a,3-diazacyclopenta[cd]pentalen-2-one
Chemical Structure Depiction of
4,4,6a,6b-tetramethyl-3-phenylhexahydro-2H,3H-1-oxa-2a,3-diazacyclopenta[cd]pentalen-2-one
4,4,6a,6b-tetramethyl-3-phenylhexahydro-2H,3H-1-oxa-2a,3-diazacyclopenta[cd]pentalen-2-one
Compound characteristics
| Compound ID: | 8008-8233 |
| Compound Name: | 4,4,6a,6b-tetramethyl-3-phenylhexahydro-2H,3H-1-oxa-2a,3-diazacyclopenta[cd]pentalen-2-one |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C17 H22 N2 O2 |
| Smiles: | CC1(C)C2CCC3(C)C2(C)N(C(=O)O3)N1c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4149 |
| logD: | 3.4149 |
| logSw: | -3.6913 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.8421 |
| InChI Key: | NSUOGCYPVWQKRF-UHFFFAOYSA-N |