tert-butyl 2-{[(3-methoxyphenyl)methyl]sulfanyl}-3-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate
Chemical Structure Depiction of
tert-butyl 2-{[(3-methoxyphenyl)methyl]sulfanyl}-3-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate
tert-butyl 2-{[(3-methoxyphenyl)methyl]sulfanyl}-3-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate
Compound characteristics
| Compound ID: | C200-6723 |
| Compound Name: | tert-butyl 2-{[(3-methoxyphenyl)methyl]sulfanyl}-3-(thiophen-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate |
| Molecular Weight: | 471.64 |
| Molecular Formula: | C24 H29 N3 O3 S2 |
| Smiles: | CC(C)(C)OC(N1CCC2(CC1)N=C(C(=N2)SCc1cccc(c1)OC)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2637 |
| logD: | 5.2637 |
| logSw: | -5.1386 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.533 |
| InChI Key: | DALDLCABHPAADI-UHFFFAOYSA-N |