BAS 12411440
TL;DR: BAS 12411440 (CAS 848746-44-1) 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.
5,5-dimethyl-N-(3-morpholin-4-ylpropyl)-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-amine
Also Known As: BAS 12411440, 8,8-dimethyl-N-(3-morpholinopropyl)-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, 8,8-dimethyl-N-[3-(morpholin-4-yl)propyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, N-(8,8-DIMETHYL-7,10-DIHYDRO-8H-PYRANO[3'',4'':5',6']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDIN-4-YL)-N-(3-MORPHOLINOPROPYL)AMINE
| Molecular Formula | C21H27N5O2S |
|---|---|
| Molecular Weight | 413.19 g/mol |
| LogP | 3.225 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.18854 |
| Heavy Atoms | 29 |
| Complexity | 1028.7515 |
Chemical Identifiers
| CAS Number | 848746-44-1 |
|---|---|
| SMILES | CC1(CC2=NC3=C(C=C2CO1)C4=C(S3)C(=NC=N4)NCCCN5CCOCC5)C |
Product Overview
BAS 12411440 (CAS 848746-44-1), with molecular formula C21H27N5O2S and molecular weight 413.19 g/mol. IUPAC: 5,5-dimethyl-N-(3-morpholin-4-ylpropyl)-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-amine.
Chemical Property Profile of BAS 12411440
Property Insights of BAS 12411440
The XLogP value of 3.225 indicates that BAS 12411440 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12411440. Following Lipinski's Rule of Five, BAS 12411440 has 1 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 12411440?
The CAS number of BAS 12411440 is 848746-44-1.
What is the molecular formula of BAS 12411440?
The molecular formula of BAS 12411440 is C21H27N5O2S.
What is the molecular weight of BAS 12411440?
The molecular weight of BAS 12411440 is 413.19 g/mol.
Where can I buy BAS 12411440?
You can request a quote for BAS 12411440 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12411440?
Yes, KEHONG BIO provides custom synthesis services for BAS 12411440 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.