3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)propanamide
Chemical Structure Depiction of
3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)propanamide
3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)propanamide
Compound characteristics
| Compound ID: | C741-0415 |
| Compound Name: | 3-(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)-N-(3-{cyclopentyl[(furan-2-yl)methyl]amino}propyl)propanamide |
| Molecular Weight: | 552.68 |
| Molecular Formula: | C32 H36 N6 O3 |
| Smiles: | C1CCC(C1)N(CCCNC(CCc1nnc2N(Cc3ccccc3)C(c3ccccc3n12)=O)=O)Cc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 3.2524 |
| logD: | 1.8931 |
| logSw: | -3.7069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.961 |
| InChI Key: | IVVJLSQOOSODEH-UHFFFAOYSA-N |