BAS 02287639
TL;DR: BAS 02287639 (CAS 351162-52-2) is a chemical compound with molecular formula C27H26N2O3S2 and molecular weight 490.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-5-phenacylsulfanyl-4-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: BAS 02287639, 6,6-dimethyl-2-((2-oxo-2-phenylethyl)thio)-3-phenethyl-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one, 6,6-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(2-phenylethyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one, 6,6-DIMETHYL-2-[(2-OXO-2-PHENYLETHYL)SULFANYL]-3-PHENETHYL-3,5,6,8-TETRAHYDRO-4H-PYRANO[4',3':4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE, 6,6-dimethyl-2-phenacylsulfanyl-3-(2-phenylethyl)-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one
| Molecular Formula | C27H26N2O3S2 |
|---|---|
| Molecular Weight | 490.14 g/mol |
| LogP | 5.527 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.1385 |
| Heavy Atoms | 34 |
| Complexity | 1392.4202 |
Chemical Identifiers
| CAS Number | 351162-52-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CCC5=CC=CC=C5)C |
Product Overview
BAS 02287639 (CAS 351162-52-2), with molecular formula C27H26N2O3S2 and molecular weight 490.14 g/mol. IUPAC: 12,12-dimethyl-5-phenacylsulfanyl-4-(2-phenylethyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of BAS 02287639
Property Insights of BAS 02287639
The XLogP value of 5.527 indicates that BAS 02287639 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02287639. Following Lipinski's Rule of Five, BAS 02287639 has 0 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 BAS 02287639?
The CAS number of BAS 02287639 is 351162-52-2.
What is the molecular formula of BAS 02287639?
The molecular formula of BAS 02287639 is C27H26N2O3S2.
What is the molecular weight of BAS 02287639?
The molecular weight of BAS 02287639 is 490.14 g/mol.
Where can I buy BAS 02287639?
You can request a quote for BAS 02287639 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02287639?
Yes, KEHONG BIO provides custom synthesis services for BAS 02287639 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.