BAS 12411429
TL;DR: BAS 12411429 (CAS 846064-25-3) is a chemical compound with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-(2-methoxyethyl)-5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-15-one
Also Known As: BAS 12411429, 3-(2-methoxyethyl)-8,8-dimethyl-7,8-dihydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(10H)-one, 3-(2-methoxyethyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
| Molecular Formula | C17H19N3O3S |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 2.5039 |
| Topological Polar Surface Area | 66.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.11472 |
| Heavy Atoms | 24 |
| Complexity | 990.059 |
Chemical Identifiers
| CAS Number | 846064-25-3 |
|---|---|
| SMILES | CC1(CC2=NC3=C(C=C2CO1)C4=C(S3)C(=O)N(C=N4)CCOC)C |
Product Overview
BAS 12411429 (CAS 846064-25-3), with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol. IUPAC: 14-(2-methoxyethyl)-5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-15-one.
Chemical Property Profile of BAS 12411429
Property Insights of BAS 12411429
The XLogP value of 2.5039 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12411429. The TPSA of 66.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12411429. Following Lipinski's Rule of Five, BAS 12411429 has 0 hydrogen bond donor(s) and 6 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 12411429?
The CAS number of BAS 12411429 is 846064-25-3.
What is the molecular formula of BAS 12411429?
The molecular formula of BAS 12411429 is C17H19N3O3S.
What is the molecular weight of BAS 12411429?
The molecular weight of BAS 12411429 is 345.11 g/mol.
Where can I buy BAS 12411429?
You can request a quote for BAS 12411429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12411429?
Yes, KEHONG BIO provides custom synthesis services for BAS 12411429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.