BAS 10834169
TL;DR: BAS 10834169 (CAS 840464-41-7) is a chemical compound with molecular formula C21H27N5O2S and molecular weight 413.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4,4-dimethyl-8-pyrrolidin-1-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]propan-1-ol
Also Known As: BAS 10834169, 3-((2,2-dimethyl-5-(pyrrolidin-1-yl)-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino)propan-1-ol, 3-{[2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amino}propan-1-ol
| Molecular Formula | C21H27N5O2S |
|---|---|
| Molecular Weight | 413.19 g/mol |
| LogP | 3.4853 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.18854 |
| Heavy Atoms | 29 |
| Complexity | 1058.3279 |
Chemical Identifiers
| CAS Number | 840464-41-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC=N4)NCCCO)N5CCCC5)C |
Product Overview
BAS 10834169 (CAS 840464-41-7), with molecular formula C21H27N5O2S and molecular weight 413.19 g/mol. IUPAC: 3-[(4,4-dimethyl-8-pyrrolidin-1-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]propan-1-ol.
Chemical Property Profile of BAS 10834169
Property Insights of BAS 10834169
The XLogP value of 3.4853 indicates that BAS 10834169 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10834169. Following Lipinski's Rule of Five, BAS 10834169 has 2 hydrogen bond donor(s) and 8 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 10834169?
The CAS number of BAS 10834169 is 840464-41-7.
What is the molecular formula of BAS 10834169?
The molecular formula of BAS 10834169 is C21H27N5O2S.
What is the molecular weight of BAS 10834169?
The molecular weight of BAS 10834169 is 413.19 g/mol.
Where can I buy BAS 10834169?
You can request a quote for BAS 10834169 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10834169?
Yes, KEHONG BIO provides custom synthesis services for BAS 10834169 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.