clomipramine

clomipramine

CAS: 303-49-1

Formula: C19H23ClN2

SMILES: CN(C)CCCN1C2=CC=CC=C2CCC2=CC=C(Cl)C=C12

IUPAC: (3-{5-chloro-2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}propyl)dimethylamine

InChI: InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3

Composition: C (72.48%), H (7.36%), Cl (11.26%), N (8.90%)

Molar Mass: 314.86

Atom Count: 45

Heavy Atom Count: 22

Properties

Properties

Common Names	3-chloroimipramine; anafranil (free base); anafranil base; chlomipramine; chlorimipramine; clomicalm; clomipramina; clomipramina [inn-spanish]; clomipramine; clomipramine (product); clomipramine (substance); clomipramine hcl; clomipramine hydrochloride (product); clomipramine hydrochloride (substance); clomipramine hydrochloride preparation; clomipramine maleate (1:1); clomipramine preparation; clomipraminum; hydiphen; hydrochloride, clomipramine; monochlorimipramine; monohydrochloride, clomipramine; 氯米帕明
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	314.1549764
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	GDLIGKIOYRNHDA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.41
Topological Polar Surface Area	6.48
Polarizability	36.47
Ring Count	3
Rotatable Bond Count	4

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