2-(4-bromophenyl)-1,2,4-triazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
2-(4-bromophenyl)-1,2,4-triazaspiro[4.5]decan-3-one
2-(4-bromophenyl)-1,2,4-triazaspiro[4.5]decan-3-one
Compound characteristics
Compound ID: | J063-0242 |
Compound Name: | 2-(4-bromophenyl)-1,2,4-triazaspiro[4.5]decan-3-one |
Molecular Weight: | 310.19 |
Molecular Formula: | C13 H16 Br N3 O |
Smiles: | C1CCC2(CC1)NC(N(c1ccc(cc1)[Br])N2)=O |
Stereo: | ACHIRAL |
logP: | 3.4385 |
logD: | 3.4385 |
logSw: | -3.5302 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 41.055 |
InChI Key: | BYQWKHXPFHSZRS-UHFFFAOYSA-N |