N-cyclopentyl-3-[1-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Chemical Structure Depiction of
N-cyclopentyl-3-[1-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
N-cyclopentyl-3-[1-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Compound characteristics
| Compound ID: | L942-0237 |
| Compound Name: | N-cyclopentyl-3-[1-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C23 H30 N6 O4 S |
| Smiles: | COCCCNC(CSc1nnc2N(CCC(NC3CCCC3)=O)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1414 |
| logD: | 1.1414 |
| logSw: | -2.2939 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.78 |
| InChI Key: | XMZZLGRELAGZBP-UHFFFAOYSA-N |