4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-(3,5-difluorobenzene-1-sulfonyl)-2-azaspiro[4.5]decane
Chemical Structure Depiction of
4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-(3,5-difluorobenzene-1-sulfonyl)-2-azaspiro[4.5]decane
4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-(3,5-difluorobenzene-1-sulfonyl)-2-azaspiro[4.5]decane
Compound characteristics
Compound ID: | SC68-1671 |
Compound Name: | 4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-(3,5-difluorobenzene-1-sulfonyl)-2-azaspiro[4.5]decane |
Molecular Weight: | 436.52 |
Molecular Formula: | C21 H26 F2 N4 O2 S |
Smiles: | C1CCC2(CC1)CN(CC2c1nncn1CC1CC1)S(c1cc(cc(c1)F)F)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3213 |
logD: | 3.3213 |
logSw: | -3.6369 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 56.711 |
InChI Key: | JHNXUEPIBSFJMJ-IBGZPJMESA-N |