9-(thiophene-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Chemical Structure Depiction of
9-(thiophene-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
9-(thiophene-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Compound characteristics
| Compound ID: | L676-1267 |
| Compound Name: | 9-(thiophene-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-1,4,9-triazaspiro[5.5]undec-4-en-5-amine |
| Molecular Weight: | 509.01 |
| Molecular Formula: | C20 H23 F3 N4 O2 S2 |
| Salt: | HCl |
| Smiles: | C1CN(CCC12C(NCc1ccc(cc1)C(F)(F)F)=NCCN2)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0654 |
| logD: | -0.7089 |
| logSw: | -3.4374 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.384 |
| InChI Key: | DTZIUAASXPLRDF-UHFFFAOYSA-N |