1H-Benzimidazole,5-chloro-1-(4-piperidinyl)
TL;DR: 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) (CAS 9079-33-8) is a chemical compound with molecular formula C35H48ClN2NaO11S and molecular weight 762.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;3-[[3-[bis[2-(2-hydroxyethoxy)ethyl]amino]phenyl]-[4-[bis[2-(2-hydroxyethoxy)ethyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]benzenesulfonate;chloride
Also Known As: 1H-Benzimidazole,5-chloro-1-(4-piperidinyl), 2-Propenoic acid, polymer with ammonium 2-propenoate, Poly(oxy-1,2-ethanediyl), .alpha.,.alpha.',.alpha.'',.alpha.'''-[[(2-sulfophenyl)methyliumylidene]bis(4,1-phenylenenitrilodi-2,1-ethanediyl)]tetrakis[.omega.-hydroxy-, chloride, monosodium salt, (C2-H4-O)mult-(C2-H4-O)mult-(C2-H4-O)mult-(C2-H4-O)mult-C27-H33-N2-O7-S.Cl.Na, Methylium chloride, bis(p-(N,N-bis(hydroxyethylpolyoxyethylene)aminophenyl)-o-sulfophenyl-, monosodium salt
| Molecular Formula | C35H48ClN2NaO11S |
|---|---|
| Molecular Weight | 762.26 g/mol |
| LogP | -5.1779 |
| Topological Polar Surface Area | 190.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 23 |
| Exact Mass | 762.25653 |
| Heavy Atoms | 51 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 9079-33-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N(CCOCCO)CCOCCO)C(=C2C=CC(=[N+](CCOCCO)CCOCCO)C=C2)C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Cl-] |
| InChIKey | AEVYFJJIZBRDSO-UHFFFAOYSA-M |
Product Overview
1H-Benzimidazole,5-chloro-1-(4-piperidinyl) (CAS 9079-33-8), with molecular formula C35H48ClN2NaO11S and molecular weight 762.26 g/mol. IUPAC: sodium;3-[[3-[bis[2-(2-hydroxyethoxy)ethyl]amino]phenyl]-[4-[bis[2-(2-hydroxyethoxy)ethyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]benzenesulfonate;chloride.
Chemical Property Profile of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)
Property Insights of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)
The XLogP value of -5.1779 indicates that 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.0 Ų indicates high polarity, suggesting 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)?
The CAS number of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) is 9079-33-8.
What is the molecular formula of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)?
The molecular formula of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) is C35H48ClN2NaO11S.
What is the molecular weight of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)?
The molecular weight of 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) is 762.26 g/mol.
Where can I buy 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)?
You can request a quote for 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole,5-chloro-1-(4-piperidinyl)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole,5-chloro-1-(4-piperidinyl) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.