Etoperidone Hydrochloride

CAT: 0024-sc-211494ASize: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-211494ASize:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

57775-22-1

Chemical Information

3H-1,2,4-Triazol-3-one, 2-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-4,5-diethyl-2,4-dihydro-, hydrochloride (1:1)

CAS Number	57775-22-1
PubChem CID	65472
IUPAC Name	2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4,5-diethyl-1,2,4-triazol-3-one;hydrochloride
Molecular Formula	C19H29Cl2N5O
Molecular Weight	414.4
Topological Polar Surface Area	42.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Heavy Atom Count	27
Formal Charge	0
Complexity	506

SMILES

CCC1=NN(C(=O)N1CC)CCCN2CCN(CC2)C3=CC(=CC=C3)Cl.Cl

InChI

InChI=1S/C19H28ClN5O.ClH/c1-3-18-21-25(19(26)24(18)4-2)10-6-9-22-11-13-23(14-12-22)17-8-5-7-16(20)15-17;/h5,7-8,15H,3-4,6,9-14H2,1-2H3;1H

InChIKey

BHKPQZVLIZKSAG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 57775-22-1

CID: 65472

Formula: C19H29Cl2N5O

MW: 414.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	414.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	413.1749160
Monoisotopic Mass	413.1749160
Topological Polar Surface Area	42.4 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	506
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
sc-497423	Etoperidone-d8 Hydrochloride
sc-268821	Cyclopropanecarboxamidine hydrochloride
sc-215245	Lidocaine Hydrochloride
sc-202537C	Chlorpromazine, Hydrochloride
sc-397050	Todralazine hydrochloride
sc-205785B	Oxytetracycline Hydrochloride
sc-205785	Oxytetracycline Hydrochloride
sc-200199D	Diltiazem hydrochloride
sc-351726	Diphenidol hydrochloride
sc-200921C	Daunorubicin hydrochloride

Catalog	Name
011868	Etoperidone Hydrochloride
HY-106617A	Etoperidone (hydrochloride)
HY-106617AS-01	Etoperidone-d8 (hydrochloride)
011869	Etoperidone-d8 Hydrochloride
T201838-01	Etoperidone
300563	Ligustrazine Hydrochloride (Chuanxiongzine hydrochloride)
D3190-91G	Deoxynojirimycin Hydrochloride (DNJ Hydrochloride)
OR1043462-01	Hydrochloride
C8905-07	O-Cyclopropylmethyl-hydroxylamine, Hydrochloride (Cyclopropylmethoxyamine, Hydrochloride, Cyclopropylmethoxylamine, Hydrochloride)
C7050-01	Cysteamine hydrochloride; 2-AminoeThanethiol Hydrochloride; 2-Aminoethane-1-Thiol Hydrochloride; Mercaptamine Hydrochloride