Cyproheptadine hydrochloride sesquihydrate (CAS 41354-29-4)

Cyproheptadine hydrochloride sesquihydrate (CAS 41354-29-4) is a chemical compound registered under number CAS 41354-29-4, with the molecular formula C₄₂H₅₀Cl₂N₂O₃, and a molar mass of 701.8 g/mol.

The molecule contains 99 atoms connected by 100 chemical bonds. The full systematic IUPAC name of this compound is bis(1-methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)piperidine);trihydrate;dihydrochloride. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, polar surface area PSA = 9.5 Ų, 5 donors and 5 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Wzór sumaryczny	C₄₂H₅₀Cl₂N₂O₃
Masa molowa	701.8 g/mol
IUPAC	bis(1-methyl-4-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)piperidine);trihydrate;dihydrochloride
SMILES	CN1CCC(=C2C3=CC=CC=C3C=CC4=CC=CC=C42)CC1.CN1CCC(=C2C3=CC=CC=C3C=CC4=CC=CC=C42)CC1.O.O.O.Cl.Cl
InChIKey	ZEAUHIZSRUAMQG-UHFFFAOYSA-N
logP (XLogP3)	—
PSA	9.5 Ų
HBD / HBA	5 / 5
PubChem CID	CID 11954233 ↗

Sygnał: Niebezpieczeństwo

Cyproheptadine hydrochloride sesquihydrate · RefChem:1082804 · DTXCID20196575 · 41354-29-4 · MFCD27967225 · cyproheptadine hydrochloride hydrate · Piperidine, 4-(5H-dibenzo[a,d]cyclohepten-5-ylidene)-1-methyl-, hydrochloride, hydrate (2:2:3) · 4-(5H-Dibenzo(a,d)cyclohepten-5-ylidene)-1-methylpiperidine hydrochloride sesquihydrate · 4-(5H-dibenzo[a,d][7]annulen-5-ylidene)-1-methylpiperidine hydrochloride sesquihydrate · Piperidine, 4-(5H-dibenzo(a,d)cyclohepten-5-ylidene)-1-methyl-, hydrochloride, sesquihydrate · UNII-NJ82J0F8QC · 4-(5H-Dibenzo[a,d]cyclohepten-5-ylidene)-1-methylpiperidine hydrochloride sesquihydrate · Periactin (TN) · PIPERIDINE, 4-(5H-DIBENZO(A,D)CYCLOHEPTEN-5-YLIDENE)-1-METHYL-, HYDROCHLORIDE, HYDRATE (2:2:3) · Piperidine, 4-(5H-dibenzo[a,d]cyclohepten-5-ylidene)-1-methyl-,hydrochloride, hydrate (2:3)

• 📊 PubChem CID 11954233 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność

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