CBKinase1_007259
TL;DR: CBKinase1_007259 (CAS 708232-01-3) is a chemical compound with molecular formula C19H17N5O4S2 and molecular weight 443.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea
Also Known As: CBKinase1_007259, CBKinase1_019659, BRD-K12735478-001-01-3, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea, [(4-{[(2H,3H-benzo[3,4-e]1,4-dioxan-6-ylamino)thioxomethyl]amino}phenyl)sulfon yl]pyrimidin-2-ylamine
| Molecular Formula | C19H17N5O4S2 |
|---|---|
| Molecular Weight | 443.07 g/mol |
| LogP | 2.8575 |
| Topological Polar Surface Area | 114.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.0722 |
| Heavy Atoms | 30 |
| Complexity | 1155.3021 |
Chemical Identifiers
| CAS Number | 708232-01-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4 |
Product Overview
CBKinase1_007259 (CAS 708232-01-3), with molecular formula C19H17N5O4S2 and molecular weight 443.07 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea.
Chemical Property Profile of CBKinase1_007259
Property Insights of CBKinase1_007259
The XLogP value of 2.8575 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007259. The TPSA of 114.47 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007259. Following Lipinski's Rule of Five, CBKinase1_007259 has 3 hydrogen bond donor(s) and 7 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 CBKinase1_007259?
The CAS number of CBKinase1_007259 is 708232-01-3.
What is the molecular formula of CBKinase1_007259?
The molecular formula of CBKinase1_007259 is C19H17N5O4S2.
What is the molecular weight of CBKinase1_007259?
The molecular weight of CBKinase1_007259 is 443.07 g/mol.
Where can I buy CBKinase1_007259?
You can request a quote for CBKinase1_007259 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007259?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007259 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.