2-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
2-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C888-0669 |
| Compound Name: | 2-{[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C24 H21 Cl N4 O2 |
| Smiles: | CCC1=NN(Cc2c(C)oc(c3cccc(c3)[Cl])n2)C(c2cc3cc(C)ccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.414 |
| logD: | 5.4067 |
| logSw: | -5.8275 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.59 |
| InChI Key: | XNFVTTPBQDQJEH-UHFFFAOYSA-N |