Description
Key facts
CAS number:149007-54-5,
Purity:>99%,
Form:SolidSee storage information,
Molecular weight:468.5 Da,
Molecular formula:C24H35Cl2N3O2,
PubChem:14801907,
Nature:Synthetic,
Solubility:Soluble in water to 10 mMSoluble in DMSO to 100 mM,
Biochemical name:(S)-N-Tert-butyl-3-(4-(2-methoxyphenyl)-piperazin-1-YL)-2-phenylpropanamide dihydrochloride,
Biological description:Potent, selective 5-HT1A receptor antagonist (IC50 = 15 nM). Active *in vivo*.,
Canonical smiles:CC(C)(C)NC(=O)C(CN1CCN(CC1)C2=CC=CC=C2OC)C3=CC=CC=C3.Cl.Cl,
Isomeric smiles:CC(C)(C)NC(=O)[C@H](CN1CCN(CC1)C2=CC=CC=C2OC)C3=CC=CC=C3.Cl.Cl,
InChi:InChI=1S/C24H33N3O2.2ClH/c1-24(2,3)25-23(28)20(19-10-6-5-7-11-19)18-26-14-16-27(17-15-26)21-12-8-9-13-22(21)29-4;;/h5-13,20H,14-18H2,1-4H3,(H,25,28);2*1H/t20-;;/m1../s1,
InChiKey:VJGZNBYDSDEOED-FAVHNTAZSA-N,
IUPAC Name:(2S)-N-tert-butyl-3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-phenylpropanamide;dihydrochloride
Properties and Storage Information:
Shipped at conditions-Ambient - Can Ship with Ice, Appropriate short-term storage conditions-Ambient, Appropriate long-term storage conditions-Ambient
