N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Compound characteristics
| Compound ID: | C741-0506 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C27 H28 F N5 O2 |
| Smiles: | C1CCC(CCNC(CCc2nnc3N(Cc4ccc(cc4)F)C(c4ccccc4n23)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.0737 |
| logD: | 3.0737 |
| logSw: | -3.6127 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.211 |
| InChI Key: | DHOJEGWAJUXTGW-UHFFFAOYSA-N |