CBKinase1_009761
TL;DR: CBKinase1_009761 (CAS 578747-97-4) is a chemical compound with molecular formula C26H29N3O2S and molecular weight 447.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[7,7-dimethyl-2-(4-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-N-(4-methylphenyl)propanamide
Also Known As: CBKinase1_009761, CBKinase1_022161, 2-[[7,7-dimethyl-2-(4-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-N-(4-methylphenyl)propanamide, 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(4-methylphenyl)propanamide, 2-((7,7-dimethyl-2-(p-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-N-(p-tolyl)propanamide
| Molecular Formula | C26H29N3O2S |
|---|---|
| Molecular Weight | 447.20 g/mol |
| LogP | 5.73104 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.19806 |
| Heavy Atoms | 32 |
| Complexity | 1125.059 |
Chemical Identifiers
| CAS Number | 578747-97-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(COC(C3)(C)C)C(=N2)SC(C)C(=O)NC4=CC=C(C=C4)C |
Product Overview
CBKinase1_009761 (CAS 578747-97-4), with molecular formula C26H29N3O2S and molecular weight 447.20 g/mol. IUPAC: 2-[[7,7-dimethyl-2-(4-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-N-(4-methylphenyl)propanamide.
Chemical Property Profile of CBKinase1_009761
Property Insights of CBKinase1_009761
The XLogP value of 5.73104 indicates that CBKinase1_009761 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_009761. Following Lipinski's Rule of Five, CBKinase1_009761 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_009761?
The CAS number of CBKinase1_009761 is 578747-97-4.
What is the molecular formula of CBKinase1_009761?
The molecular formula of CBKinase1_009761 is C26H29N3O2S.
What is the molecular weight of CBKinase1_009761?
The molecular weight of CBKinase1_009761 is 447.20 g/mol.
Where can I buy CBKinase1_009761?
You can request a quote for CBKinase1_009761 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_009761?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_009761 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.