8-(3-chlorobenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(3-chlorobenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(3-chlorobenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
Compound ID: | G651-0963 |
Compound Name: | 8-(3-chlorobenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
Molecular Weight: | 433.91 |
Molecular Formula: | C20 H20 Cl N3 O4 S |
Smiles: | COc1cccc(c1)C1C(NC2(CCN(CC2)S(c2cccc(c2)[Cl])(=O)=O)N=1)=O |
Stereo: | ACHIRAL |
logP: | 3.2496 |
logD: | 3.2472 |
logSw: | -3.813 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.844 |
InChI Key: | IFQTXEWHYGPMRQ-UHFFFAOYSA-N |