8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0956 |
| Compound Name: | 8-(4-tert-butylbenzene-1-sulfonyl)-3-(3-methoxyphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCC2(CC1)NC(C(c1cccc(c1)OC)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4496 |
| logD: | 4.4473 |
| logSw: | -4.2353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.844 |
| InChI Key: | WYMCTBYPIHSPJS-UHFFFAOYSA-N |