71-18 R&C
TL;DR: 71-18 R&C (CAS 1642-12-2) is a chemical compound with molecular formula C17H23BrN2O3S and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)sulfonyl-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboxamide
Also Known As: 71-18 R&C, N-((4-Bromophenyl)sulfonyl)-1,8,8-trimethyl-3-azabicyclo(3.2.1)octane-3-carboxamide, (Bromo-4 benzene sulfonylamino-carbonyl)-3 trimethyl-1,8,8 3-azabicyclo(3,2,1)octane [French], 3-Azabicyclo(3.2.1)octane-3-carboxamide, N-((4-bromophenyl)sulfonyl)-1,8,8-trimethyl-, (Bromo-4 benzene sulfonylamino-carbonyl)-3 trimethyl-1,8,8 3-azabicyclo(3,2,1)octane
| Molecular Formula | C17H23BrN2O3S |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.06128 |
| Heavy Atoms | 24 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 1642-12-2 |
|---|---|
| SMILES | CC1(C2CCC1(CN(C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)Br)C)C |
| InChIKey | CKVVWZRGLIVIMU-UHFFFAOYSA-N |
Product Overview
71-18 R&C (CAS 1642-12-2), with molecular formula C17H23BrN2O3S and molecular weight 414.06 g/mol. IUPAC: N-(4-bromophenyl)sulfonyl-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboxamide.
Chemical Property Profile of 71-18 R&C
Property Insights of 71-18 R&C
The XLogP value of 3.7 indicates that 71-18 R&C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 71-18 R&C. Following Lipinski's Rule of Five, 71-18 R&C has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 71-18 R&C?
The CAS number of 71-18 R&C is 1642-12-2.
What is the molecular formula of 71-18 R&C?
The molecular formula of 71-18 R&C is C17H23BrN2O3S.
What is the molecular weight of 71-18 R&C?
The molecular weight of 71-18 R&C is 414.06 g/mol.
Where can I buy 71-18 R&C?
You can request a quote for 71-18 R&C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 71-18 R&C?
Yes, KEHONG BIO provides custom synthesis services for 71-18 R&C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.