N-[(4-chlorophenyl)methyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
N-[(4-chlorophenyl)methyl]-2-{[3-(thiophen-2-yl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G698-0135 |
Compound Name: | N-[(4-chlorophenyl)methyl]-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: | C1CCC2(CC1)N=C(C(=N2)SCC(NCc1ccc(cc1)[Cl])=O)c1cccs1 |
Stereo: | ACHIRAL |
logP: | 4.5412 |
logD: | 4.5412 |
logSw: | -4.7331 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.571 |
InChI Key: | NJSJPSCDLTZKIC-UHFFFAOYSA-N |