N-cyclopentyl-9-(4-fluorobenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-cyclopentyl-9-(4-fluorobenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
N-cyclopentyl-9-(4-fluorobenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | L676-0184 |
| Compound Name: | N-cyclopentyl-9-(4-fluorobenzene-1-sulfonyl)-1,4,9-triazaspiro[5.5]undec-4-en-5-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 430.97 |
| Molecular Formula: | C19 H27 F N4 O2 S |
| Salt: | HCl |
| Smiles: | C1CCC(C1)NC1C2(CCN(CC2)S(c2ccc(cc2)F)(=O)=O)NCCN=1 |
| Stereo: | ACHIRAL |
| logP: | 2.7409 |
| logD: | 0.5041 |
| logSw: | -3.3493 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.457 |
| InChI Key: | BPCICPMXXVRYRK-UHFFFAOYSA-N |