8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
Compound ID: | G651-0623 |
Compound Name: | 8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
Molecular Weight: | 459.99 |
Molecular Formula: | C23 H26 Cl N3 O3 S |
Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCC2(CC1)NC(C(c1cccc(c1)[Cl])=N2)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0503 |
logD: | 5.0104 |
logSw: | -5.1461 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.3 |
InChI Key: | VMYVVHHNOLBETL-UHFFFAOYSA-N |