N-[2-(3-chloro-4-methylphenyl)-2H-benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-[2-(3-chloro-4-methylphenyl)-2H-benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-[2-(3-chloro-4-methylphenyl)-2H-benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
| Compound ID: | 2810-3393 |
| Compound Name: | N-[2-(3-chloro-4-methylphenyl)-2H-benzotriazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
| Molecular Weight: | 420.85 |
| Molecular Formula: | C22 H17 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1[Cl])n1nc2ccc(cc2n1)NC(c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5813 |
| logD: | 4.5795 |
| logSw: | -4.7318 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.187 |
| InChI Key: | RCYZIIOVLCNESL-UHFFFAOYSA-N |