N-cyclohexyl-9-(2,4,5-trimethylbenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-cyclohexyl-9-(2,4,5-trimethylbenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
N-cyclohexyl-9-(2,4,5-trimethylbenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | L676-2214 |
| Compound Name: | N-cyclohexyl-9-(2,4,5-trimethylbenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 469.09 |
| Molecular Formula: | C23 H36 N4 O2 S |
| Salt: | HCl |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCC2(CC1)C(NC1CCCCC1)=NCCN2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4995 |
| logD: | 1.8835 |
| logSw: | -4.1114 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.091 |
| InChI Key: | XWMPZSCEFXFYGM-UHFFFAOYSA-N |