2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-phenylquinoxaline
Chemical Structure Depiction of
2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-phenylquinoxaline
2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-phenylquinoxaline
Compound characteristics
| Compound ID: | V002-6352 |
| Compound Name: | 2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]-3-phenylquinoxaline |
| Molecular Weight: | 496.99 |
| Molecular Formula: | C25 H22 Cl F N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)S(c1ccc(c(c1)[Cl])F)(=O)=O)c1c(c2ccccc2)nc2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5702 |
| logD: | 5.5701 |
| logSw: | -6.012 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.906 |
| InChI Key: | AHXVTRGGYHTWLV-UHFFFAOYSA-N |