N-(butan-2-yl)-4-(1-ethyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-(1-ethyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
N-(butan-2-yl)-4-(1-ethyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide
Compound characteristics
Compound ID: | G589-0450 |
Compound Name: | N-(butan-2-yl)-4-(1-ethyl-1H-indole-5-sulfonyl)-1,4-diazepane-1-carboxamide |
Molecular Weight: | 406.55 |
Molecular Formula: | C20 H30 N4 O3 S |
Smiles: | CCC(C)NC(N1CCCN(CC1)S(c1ccc2c(ccn2CC)c1)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.763 |
logD: | 2.763 |
logSw: | -3.3693 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.428 |
InChI Key: | IQKCPTXBBSKXST-INIZCTEOSA-N |