tert-butyl 4-[(3-chlorophenyl)methyl]-3-oxo-2-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[(3-chlorophenyl)methyl]-3-oxo-2-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate
tert-butyl 4-[(3-chlorophenyl)methyl]-3-oxo-2-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate
Compound characteristics
| Compound ID: | C200-6872 |
| Compound Name: | tert-butyl 4-[(3-chlorophenyl)methyl]-3-oxo-2-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate |
| Molecular Weight: | 459.99 |
| Molecular Formula: | C23 H26 Cl N3 O3 S |
| Smiles: | CC(C)(C)OC(N1CCC2(CC1)N=C(C(N2Cc1cccc(c1)[Cl])=O)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.31 |
| logD: | 5.31 |
| logSw: | -5.713 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.356 |
| InChI Key: | GSOCITNBQREVEF-UHFFFAOYSA-N |