Cambridge id 6981791
TL;DR: Cambridge id 6981791 (CAS 381177-01-1) is a chemical compound with molecular formula C19H24N4OS and molecular weight 356.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-5,5,13-trimethyl-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: AJ-292/41083078, N-(butan-2-yl)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, N-(sec-butyl)-2,8,8-trimethyl-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, N-(sec-butyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine, N-butan-2-yl-5,5,13-trimethyl-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
| Molecular Formula | C19H24N4OS |
|---|---|
| Molecular Weight | 356.17 g/mol |
| LogP | 4.60962 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.16708 |
| Heavy Atoms | 25 |
| Complexity | 963.1079 |
Chemical Identifiers
| CAS Number | 381177-01-1 |
|---|---|
| SMILES | CCC(C)NC1=NC(=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C)C |
Product Overview
Cambridge id 6981791 (CAS 381177-01-1), with molecular formula C19H24N4OS and molecular weight 356.17 g/mol. IUPAC: N-butan-2-yl-5,5,13-trimethyl-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 Cambridge id 6981791
Property Insights of Cambridge id 6981791
The XLogP value of 4.60962 indicates that Cambridge id 6981791 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, Cambridge id 6981791 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cambridge id 6981791 has 1 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 Cambridge id 6981791?
The CAS number of Cambridge id 6981791 is 381177-01-1.
What is the molecular formula of Cambridge id 6981791?
The molecular formula of Cambridge id 6981791 is C19H24N4OS.
What is the molecular weight of Cambridge id 6981791?
The molecular weight of Cambridge id 6981791 is 356.17 g/mol.
Where can I buy Cambridge id 6981791?
You can request a quote for Cambridge id 6981791 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6981791?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6981791 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.