N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-cyclopentyl-5-methyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Chemical Structure Depiction of
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-cyclopentyl-5-methyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-cyclopentyl-5-methyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Compound characteristics
| Compound ID: | SA31-0792 |
| Compound Name: | N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-cyclopentyl-5-methyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide |
| Molecular Weight: | 427.93 |
| Molecular Formula: | C22 H26 Cl N5 O2 |
| Smiles: | CC1(COCc2nnc(C3CCCC3)n12)C(NCCc1c[nH]c2ccc(cc12)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1205 |
| logD: | 3.1204 |
| logSw: | -3.5617 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.353 |
| InChI Key: | PEZQIHZVVWIBHC-QFIPXVFZSA-N |