N,N-diethyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
N,N-diethyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Compound characteristics
Compound ID: | L447-0274 |
Compound Name: | N,N-diethyl-1-{2-[(propan-2-yl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide |
Molecular Weight: | 382.48 |
Molecular Formula: | C16 H26 N6 O3 S |
Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCNC(NC(C)C)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0328 |
logD: | 1.0328 |
logSw: | -2.5007 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.045 |
InChI Key: | GIICAMJWXFIORZ-UHFFFAOYSA-N |