7-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4,6-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
Chemical Structure Depiction of
7-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4,6-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
7-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4,6-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
Compound characteristics
| Compound ID: | E470-1678 |
| Compound Name: | 7-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4,6-dimethyl-3,4-dihydro-2H-1,4-benzoxazine |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1cc2c(cc1C)N(C)CCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3529 |
| logD: | 4.3529 |
| logSw: | -4.2753 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.41 |
| InChI Key: | NLVBKVSBGQGJTJ-UHFFFAOYSA-N |