BAS 12411418
TL;DR: BAS 12411418 (CAS 848733-32-4) is a chemical compound with molecular formula C18H22N4O2S and molecular weight 358.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-yl)-ethylamino]ethanol
Also Known As: BAS 12411418, 2-((8,8-dimethyl-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)(ethyl)amino)ethanol, 2-[(8,8-DIMETHYL-7,10-DIHYDRO-8H-PYRANO[3'',4'':5',6']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDIN-4-YL)(ETHYL)AMINO]-1-ETHANOL, 2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)(ethyl)amino]ethanol
| Molecular Formula | C18H22N4O2S |
|---|---|
| Molecular Weight | 358.15 g/mol |
| LogP | 2.9094 |
| Topological Polar Surface Area | 71.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.14636 |
| Heavy Atoms | 25 |
| Complexity | 937.61176 |
Chemical Identifiers
| CAS Number | 848733-32-4 |
|---|---|
| SMILES | CCN(CCO)C1=NC=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C |
Product Overview
BAS 12411418 (CAS 848733-32-4), with molecular formula C18H22N4O2S and molecular weight 358.15 g/mol. IUPAC: 2-[(5,5-dimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-yl)-ethylamino]ethanol.
Chemical Property Profile of BAS 12411418
Property Insights of BAS 12411418
The XLogP value of 2.9094 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12411418. The TPSA of 71.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12411418. Following Lipinski's Rule of Five, BAS 12411418 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 12411418?
The CAS number of BAS 12411418 is 848733-32-4.
What is the molecular formula of BAS 12411418?
The molecular formula of BAS 12411418 is C18H22N4O2S.
What is the molecular weight of BAS 12411418?
The molecular weight of BAS 12411418 is 358.15 g/mol.
Where can I buy BAS 12411418?
You can request a quote for BAS 12411418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12411418?
Yes, KEHONG BIO provides custom synthesis services for BAS 12411418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.