3-(4-chlorobenzene-1-sulfonyl)-N-[(3-methoxyphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(4-chlorobenzene-1-sulfonyl)-N-[(3-methoxyphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(4-chlorobenzene-1-sulfonyl)-N-[(3-methoxyphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0082 |
| Compound Name: | 3-(4-chlorobenzene-1-sulfonyl)-N-[(3-methoxyphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 479.94 |
| Molecular Formula: | C23 H18 Cl N5 O3 S |
| Smiles: | COc1cccc(CNc2c3ccccc3n3c(c(nn3)S(c3ccc(cc3)[Cl])(=O)=O)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8586 |
| logD: | 4.8586 |
| logSw: | -4.9596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.161 |
| InChI Key: | KHTGEFZHESQVAL-UHFFFAOYSA-N |