N-[4-(azepane-1-sulfonyl)phenyl]-4-chloro-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-4-chloro-2-nitrobenzamide
N-[4-(azepane-1-sulfonyl)phenyl]-4-chloro-2-nitrobenzamide
Compound characteristics
Compound ID: | Y032-3508 |
Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-4-chloro-2-nitrobenzamide |
Molecular Weight: | 437.9 |
Molecular Formula: | C19 H20 Cl N3 O5 S |
Smiles: | C1CCCN(CC1)S(c1ccc(cc1)NC(c1ccc(cc1[N+]([O-])=O)[Cl])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.996 |
logD: | 1.9716 |
logSw: | -4.4646 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.452 |
InChI Key: | AZUMLCZGXQGJID-UHFFFAOYSA-N |