N-{9-[(4-chlorophenyl)sulfonyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-yl}-N-(2-fluorobenzyl)amine
AlkaPlorer ID: AK353139
Synonym: None
IUPAC Name: 9-(4-chlorophenyl)sulfonyl-N-[(2-fluorophenyl)methyl]-1,4,9-triazaspiro[5.5]undec-4-en-5-amine
Structure
SMILES: O=S(=O)(C1=CC=C(Cl)C=C1)N1CCC2(CC1)NCCN=C2NCC1=CC=CC=C1F
InChI: InChI=1S/C21H24ClFN4O2S/c22-17-5-7-18(8-6-17)30(28,29)27-13-9-21(10-14-27)20(24-11-12-26-21)25-15-16-3-1-2-4-19(16)23/h1-8,26H,9-15H2,(H,24,25)
InChIKey: CFMPSTDMNFNEEU-UHFFFAOYSA-N
Reference
PubChem CID: 53120417
Source
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Properties Information
Molecule Weight: 450.96700000000016
TPSA？: 73.8
MolLogP？: 2.7939000000000007
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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