CBKinase1_007373
TL;DR: CBKinase1_007373 (CAS 708238-67-9) is a chemical compound with molecular formula C27H34N4O5S3 and molecular weight 590.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(1-adamantylsulfamoyl)phenyl]carbamothioylamino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: CBKinase1_007373, CBKinase1_019773, BRD-K51251288-001-01-3, methyl 2-(3-(4-(N-(adamantan-1-yl)sulfamoyl)phenyl)thioureido)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate, methyl 2-[[4-(1-adamantylsulfamoyl)phenyl]carbamothioylamino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
| Molecular Formula | C27H34N4O5S3 |
|---|---|
| Molecular Weight | 590.17 g/mol |
| LogP | 4.60092 |
| Topological Polar Surface Area | 116.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 590.1691 |
| Heavy Atoms | 39 |
| Complexity | 1380.2086 |
Chemical Identifiers
| CAS Number | 708238-67-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC34CC5CC(C3)CC(C5)C4)C(=O)N(C)C |
Product Overview
CBKinase1_007373 (CAS 708238-67-9), with molecular formula C27H34N4O5S3 and molecular weight 590.17 g/mol. IUPAC: methyl 2-[[4-(1-adamantylsulfamoyl)phenyl]carbamothioylamino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_007373
Property Insights of CBKinase1_007373
The XLogP value of 4.60092 indicates that CBKinase1_007373 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.84 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007373. Following Lipinski's Rule of Five, CBKinase1_007373 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_007373?
The CAS number of CBKinase1_007373 is 708238-67-9.
What is the molecular formula of CBKinase1_007373?
The molecular formula of CBKinase1_007373 is C27H34N4O5S3.
What is the molecular weight of CBKinase1_007373?
The molecular weight of CBKinase1_007373 is 590.17 g/mol.
Where can I buy CBKinase1_007373?
You can request a quote for CBKinase1_007373 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007373?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007373 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.