N-(5-chloro-2-methylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
N-(5-chloro-2-methylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G698-0303 |
Compound Name: | N-(5-chloro-2-methylphenyl)-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide |
Molecular Weight: | 432 |
Molecular Formula: | C21 H22 Cl N3 O S2 |
Smiles: | Cc1ccc(cc1NC(CSC1C(c2cccs2)=NC2(CCCCC2)N=1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.7223 |
logD: | 4.7221 |
logSw: | -4.7327 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.551 |
InChI Key: | XKKLTTCQQVATLZ-UHFFFAOYSA-N |