CBKinase1_010790
TL;DR: CBKinase1_010790 (CAS 374092-96-3) is a chemical compound with molecular formula C19H15Cl2F3N2O5S and molecular weight 510.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(2,4-dichlorobenzoyl)carbamothioylamino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Also Known As: CBKinase1_010790, CBKinase1_023190, BRD-A52924015-001-01-6, (R)-methyl 2-(4-(3-(2,4-dichlorobenzoyl)thioureido)-3-methoxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate, methyl 2-(4-(3-(2,4-dichlorobenzoyl)thioureido)-3-methoxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
| Molecular Formula | C19H15Cl2F3N2O5S |
|---|---|
| Molecular Weight | 510.00 g/mol |
| LogP | 4.0517 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 510.00308 |
| Heavy Atoms | 32 |
| Complexity | 1067.744 |
Chemical Identifiers
| CAS Number | 374092-96-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
CBKinase1_010790 (CAS 374092-96-3), with molecular formula C19H15Cl2F3N2O5S and molecular weight 510.00 g/mol. IUPAC: methyl 2-[4-[(2,4-dichlorobenzoyl)carbamothioylamino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate.
Chemical Property Profile of CBKinase1_010790
Property Insights of CBKinase1_010790
The XLogP value of 4.0517 indicates that CBKinase1_010790 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_010790. Following Lipinski's Rule of Five, CBKinase1_010790 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_010790?
The CAS number of CBKinase1_010790 is 374092-96-3.
What is the molecular formula of CBKinase1_010790?
The molecular formula of CBKinase1_010790 is C19H15Cl2F3N2O5S.
What is the molecular weight of CBKinase1_010790?
The molecular weight of CBKinase1_010790 is 510.00 g/mol.
Where can I buy CBKinase1_010790?
You can request a quote for CBKinase1_010790 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_010790?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_010790 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.