VUFB-14042

8-fluoro-5-(4-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1-benzazepine;dihydrochloride

CAS: 77796-06-6

Molecular Formula	`C23H31Cl2F2N3`
Molecular Weight	458.4 g/mol
Topological Polar Surface Area	9.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	457.1863
Heavy Atoms	30
Complexity	474.0

Chemical Identifiers

CAS Number	77796-06-6
SMILES	`CN1CCN(CC1)CCN2CCCC(C3=C2C=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl`
InChIKey	`JRCVHYZFJZMHRU-UHFFFAOYSA-N`

📖 Product Overview

VUFB-14042 (CAS: 77796-06-6) is a chemical compound with molecular formula C23H31Cl2F2N3 and molecular weight 458.4 g/mol. Its IUPAC systematic name is 8-fluoro-5-(4-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1-benzazepine;dihydrochloride. Topological Polar Surface Area 9.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 457.1863 Heavy Atoms 30 Complexity 474.0 InChI Key: JRCVHYZFJZMHRU-UHFFFAOYSA-N. SMILES: CN1CCN(CC1)CCN2CCCC(C3=C2C=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl.

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