4-Piperidinecarboxamide, 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-yl]-4-(ethylamino)-, hydrochloride (1:1)
CAS Registry Number®
686347-12-6
CAS Name
4-Piperidinecarboxamide, 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-yl]-4-(ethylamino)-, hydrochloride (1:1)Molecular Formula
C25H25Cl2N7O.ClHCite this Page
4-Piperidinecarboxamide, 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-yl]-4-(ethylamino)-, hydrochloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=919516-56-6 (retrieved ) (CAS RN: 686347-12-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
275-276 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C25H25Cl2N7O.ClH/c1-2-31-25(24(28)35)11-13-33(14-12-25)22-20-23(30-15-29-22)34(17-9-7-16(26)8-10-17)21(32-20)18-5-3-4-6-19(18)27;/h3-10,15,31H,2,11-14H2,1H3,(H2,28,35);1H
InChIKey
InChIKey=KPYUQCJBZGQHPL-UHFFFAOYSA-N
SMILES
ClC1=C(C=2N(C=3C(N2)=C(N=CN3)N4CCC(NCC)(C(N)=O)CC4)C5=CC=C(Cl)C=C5)C=CC=C1.Cl
Canonical SMILES
Cl.O=C(N)C1(NCC)CCN(C=2N=CN=C3C2N=C(C=4C=CC=CC4Cl)N3C5=CC=C(Cl)C=C5)CC1
Other Names for this Substance
- 4-Piperidinecarboxamide, 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-yl]-4-(ethylamino)-, hydrochloride (1:1)
- 4-Piperidinecarboxamide, 1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-6-yl]-4-(ethylamino)-, monohydrochloride
- Otenabant hydrochloride
- CP 945598
- CP 945598-01
Deleted or Replaced CAS Registry Numbers
919516-56-6