1H-Imidazole,sulfate
TL;DR: 1H-Imidazole,sulfate (CAS 187397-18-8) is a chemical compound with molecular formula C27H31F3N4O7S and molecular weight 612.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[5-(2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)pentanoyl]-2,4-dimethoxyphenyl]-4-(trifluoromethyl)benzenesulfonamide
Also Known As: 1H-Imidazole,sulfate, RS 102221 HYDROCHLORIDE, Biomol-NT_000133, GTPL187, RS102221HCl
| Molecular Formula | C27H31F3N4O7S |
|---|---|
| Molecular Weight | 612.19 g/mol |
| LogP | 3.5504 |
| Topological Polar Surface Area | 143.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 612.1866 |
| Heavy Atoms | 42 |
| Complexity | 1455.306 |
Chemical Identifiers
| CAS Number | 187397-18-8 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)CCCCN2CCC3(CC2)C(=O)NC(=O)N3)NS(=O)(=O)C4=CC=C(C=C4)C(F)(F)F)OC |
Product Overview
1H-Imidazole,sulfate (CAS 187397-18-8), with molecular formula C27H31F3N4O7S and molecular weight 612.19 g/mol. IUPAC: N-[5-[5-(2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)pentanoyl]-2,4-dimethoxyphenyl]-4-(trifluoromethyl)benzenesulfonamide.
Chemical Property Profile of 1H-Imidazole,sulfate
Property Insights of 1H-Imidazole,sulfate
The XLogP value of 3.5504 indicates that 1H-Imidazole,sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.14 Ų indicates high polarity, suggesting 1H-Imidazole,sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H-Imidazole,sulfate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Imidazole,sulfate?
The CAS number of 1H-Imidazole,sulfate is 187397-18-8.
What is the molecular formula of 1H-Imidazole,sulfate?
The molecular formula of 1H-Imidazole,sulfate is C27H31F3N4O7S.
What is the molecular weight of 1H-Imidazole,sulfate?
The molecular weight of 1H-Imidazole,sulfate is 612.19 g/mol.
Where can I buy 1H-Imidazole,sulfate?
You can request a quote for 1H-Imidazole,sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole,sulfate?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole,sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.