CADD522
TL;DR: CADD522 (CAS 199735-88-1) is a chemical compound with molecular formula C15H13Cl2NO3 and molecular weight 325.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,3R,4S)-3-[(3,4-dichlorophenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: CADD522
| Molecular Formula | C15H13Cl2NO3 |
|---|---|
| Molecular Weight | 325.03 g/mol |
| LogP | 3.4548 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.02725 |
| Heavy Atoms | 21 |
| Complexity | 643.80597 |
Chemical Identifiers
| CAS Number | 199735-88-1 |
|---|---|
| SMILES | C1[C@H]2C=C[C@@H]1[C@H]([C@@H]2C(=O)NC3=CC(=C(C=C3)Cl)Cl)C(=O)O |
Product Overview
CADD522 (CAS 199735-88-1), with molecular formula C15H13Cl2NO3 and molecular weight 325.03 g/mol. IUPAC: (1R,2R,3R,4S)-3-[(3,4-dichlorophenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
Chemical Property Profile of CADD522
Property Insights of CADD522
The XLogP value of 3.4548 indicates that CADD522 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CADD522. Following Lipinski's Rule of Five, CADD522 has 2 hydrogen bond donor(s) and 2 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 CADD522?
The CAS number of CADD522 is 199735-88-1.
What is the molecular formula of CADD522?
The molecular formula of CADD522 is C15H13Cl2NO3.
What is the molecular weight of CADD522?
The molecular weight of CADD522 is 325.03 g/mol.
Where can I buy CADD522?
You can request a quote for CADD522 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CADD522?
Yes, KEHONG BIO provides custom synthesis services for CADD522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.