BAS 03352676
TL;DR: BAS 03352676 (CAS 315239-18-0) is a chemical compound with molecular formula C21H28N4O3S2 and molecular weight 448.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-morpholin-4-ylpropyl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide
Also Known As: BAS 03352676, UPCMLD0ENAT0504-8557:001, 2-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(3-morpholinopropyl)acetamide, AF-399/15335564, F0844-0005
| Molecular Formula | C21H28N4O3S2 |
|---|---|
| Molecular Weight | 448.16 g/mol |
| LogP | 2.0633 |
| Topological Polar Surface Area | 76.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 448.16028 |
| Heavy Atoms | 30 |
| Complexity | 978.7673 |
Chemical Identifiers
| CAS Number | 315239-18-0 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)NCCCN3CCOCC3)SC4=C2CCC4 |
Product Overview
BAS 03352676 (CAS 315239-18-0), with molecular formula C21H28N4O3S2 and molecular weight 448.16 g/mol. IUPAC: N-(3-morpholin-4-ylpropyl)-2-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 03352676
Property Insights of BAS 03352676
The XLogP value of 2.0633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03352676. The TPSA of 76.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03352676. Following Lipinski's Rule of Five, BAS 03352676 has 1 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 BAS 03352676?
The CAS number of BAS 03352676 is 315239-18-0.
What is the molecular formula of BAS 03352676?
The molecular formula of BAS 03352676 is C21H28N4O3S2.
What is the molecular weight of BAS 03352676?
The molecular weight of BAS 03352676 is 448.16 g/mol.
Where can I buy BAS 03352676?
You can request a quote for BAS 03352676 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03352676?
Yes, KEHONG BIO provides custom synthesis services for BAS 03352676 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.