{4-[(3-methylphenyl)imino]-2-sulfanylidene-1,3-diazaspiro[4.5]decan-1-yl}acetonitrile
Chemical Structure Depiction of
{4-[(3-methylphenyl)imino]-2-sulfanylidene-1,3-diazaspiro[4.5]decan-1-yl}acetonitrile
{4-[(3-methylphenyl)imino]-2-sulfanylidene-1,3-diazaspiro[4.5]decan-1-yl}acetonitrile
Compound characteristics
| Compound ID: | 8006-6852 |
| Compound Name: | {4-[(3-methylphenyl)imino]-2-sulfanylidene-1,3-diazaspiro[4.5]decan-1-yl}acetonitrile |
| Molecular Weight: | 312.43 |
| Molecular Formula: | C17 H20 N4 S |
| Smiles: | Cc1cccc(c1)/N=C1/C2(CCCCC2)N(CC#N)C(N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.7724 |
| logD: | 3.7429 |
| logSw: | -3.8775 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.887 |
| InChI Key: | PWRMMGYGLMKLTP-UHFFFAOYSA-N |