Basic information
- CAS
3589-22-8- Standard SMILES
CN(C)CCCN1c2cc(Cl)ccc2CCc2ccc(Cl)cc21- InChIKey
ZRLHYTJLNUJZLB-UHFFFAOYSA-N- Molecular formula
- C19H22Cl2N2
- Average molar mass
- 349.3 g/mol
- Monoisotopic mass
- 348.1160041
Names & identifiers
- Preferred name
- Dichlorimipramine
- IUPAC
- 3-(2,9-dichloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
- English name
- 3,7-Dichloro-5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine
- Molecular formula
- C19H22Cl2N2
- Molecular weight
- 349.3
Names & synonyms
Dichlorimipramine3-(3,7-dichloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)-n,n-dimethylpropan-1-amineQED4UT72J0G 28364UNII-QED4UT72J05H-Dibenz(b,f)azepine, 3,7-dichloro-5-(3-(dimethylamino)propyl)-10,11-dihydro-DTXSID009573035H-Dibenz(b,f)azepine, 10,11-dihydro-3,7-dichloro-5-(3-(dimethylamino)propyl)-5H-Dibenz(b,f)azepine, 3,7-dichloro-10,11-dihydro-5-(3-(dimethylamino)propyl)-G-28364CLOMIPRAMINE HYDROCHLORIDE IMPURITY D [EP IMPURITY]3,7-DICHLORO-10,11-DIHYDRO-N,N-DIMETHYL-5H-DIBENZ(B,F)AZEPINE-5-PROPANAMINE
Show more names
CAS:3589-22-8Diclomipramine3,7-Dichloro-5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine5H-Dibenz[b,f]azepine-5-propanamine, 3,7-dichloro-10,11-dihydro-N,N-dimethyl-"3-(2,9-dichloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine"
5H-DIBENZ(B,F)AZEPINE-5-PROPANAMINE, 3,7-DICHLORO-10,11-DIHYDRO-N,N-DIMETHYL-3-(3,7-DICHLORO-10,11-DIHYDRO-5H-DIBENZO(B,F)AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINECLOMIPRAMINE HYDROCHLORIDE IMPURITY D (EP IMPURITY)RefChem:200523DTXCID0013852453589-22-8Clomipramine EP Impurity D3-(2,9-dichloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
Database identifiers
- CAS
3589-22-8- PubChem CID
- 77140
- DTXSID
DTXSID00957303- UNII
- QED4UT72J0
- Nikkaji
- J53.918J
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 348
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- form
- solid
- Major Application
- pharmaceutical (small molecule)
- InChI
- 1S/C19H22Cl2N2/c1-22(2)10-3-11-23-18-12-16(20)8-6-14(18)4-5-15-7-9-17(21)13-19(15)23/h6-9,12-13H,3-5,10-11H2,1-2H3
- InChIKey
- ZRLHYTJLNUJZLB-UHFFFAOYSA-N
- SMILES
- Clc1cc2c(cc1)CCc3c(cc(cc3)Cl)N2CCCN(C)C
- FDA UNII
- 4 UT72J0 · QED4UT72J0
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
Chemistry & industry
Applications
UsesClomipramine impurity D EP Reference standard, intended for use in laboratory tests only as specifically prescribed in the European Pharmacopoeia.
Suppliers15 total
南京济宇生物科技有限公司17712667785 18068059186 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
上海伯韵医药科技有限公司13817873692 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
珠海安哲生物科技有限公司13169972583 · [email protected]
深圳市祥根生物医药有限公司0755-28967200 13631290199 · [email protected]
南昌朗纳化工有限公司15079032866 · [email protected]
Related reactions
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Compound notes
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