Cambridge id 6641197
TL;DR: Cambridge id 6641197 (CAS 375834-97-2) is a chemical compound with molecular formula C19H19N3O3S2 and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-ylmethylsulfanyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: AB00113739-01, 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, 2-((benzo[d][1,3]dioxol-5-ylmethyl)thio)-6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6,6-dimethyl-5,8-dihydropyrano[4,5]thieno[1,2-c]pyrimidin-4-amine
| Molecular Formula | C19H19N3O3S2 |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | 4.1458 |
| Topological Polar Surface Area | 79.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.0868 |
| Heavy Atoms | 27 |
| Complexity | 1048.3462 |
Chemical Identifiers
| CAS Number | 375834-97-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=NC(=NC(=C23)N)SCC4=CC5=C(C=C4)OCO5)C |
Product Overview
Cambridge id 6641197 (CAS 375834-97-2), with molecular formula C19H19N3O3S2 and molecular weight 401.09 g/mol. IUPAC: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
Chemical Property Profile of Cambridge id 6641197
Property Insights of Cambridge id 6641197
The XLogP value of 4.1458 indicates that Cambridge id 6641197 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 6641197. Following Lipinski's Rule of Five, Cambridge id 6641197 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 Cambridge id 6641197?
The CAS number of Cambridge id 6641197 is 375834-97-2.
What is the molecular formula of Cambridge id 6641197?
The molecular formula of Cambridge id 6641197 is C19H19N3O3S2.
What is the molecular weight of Cambridge id 6641197?
The molecular weight of Cambridge id 6641197 is 401.09 g/mol.
Where can I buy Cambridge id 6641197?
You can request a quote for Cambridge id 6641197 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6641197?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6641197 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.