CCRIS 1749
TL;DR: CCRIS 1749 (CAS 97170-08-6) is a chemical compound with molecular formula C19H16O3 and molecular weight 292.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5S,6R,7S)-10-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol
Also Known As: Chryseno(3,4-b)oxirene-1,2-diol, 1,2,2a,3a-tetrahydro-10-methyl-, (1-alpha,2-beta,2a-beta,3a-beta)-, 5-Methyl-7,8,8a,9a-tetrahydrochryseno[3,4-b]oxirene-7,8-diol, (7S,8R,8aS,9aR)-5-methyl-7,8,8a,9a-tetrahydrochryseno[3,4-b]oxirene-7,8-diol
| Molecular Formula | C19H16O3 |
|---|---|
| Molecular Weight | 292.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 292.10995 |
| Heavy Atoms | 22 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 97170-08-6 |
|---|---|
| SMILES | CC1=CC2=C([C@@H]3[C@@H](O3)[C@@H]([C@H]2O)O)C4=C1C5=CC=CC=C5C=C4 |
| InChIKey | LMQWCOZFQUNBGM-MANSERQUSA-N |
Product Overview
CCRIS 1749 (CAS 97170-08-6), with molecular formula C19H16O3 and molecular weight 292.11 g/mol. IUPAC: (3R,5S,6R,7S)-10-methyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol.
Chemical Property Profile of CCRIS 1749
Property Insights of CCRIS 1749
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CCRIS 1749. With a topological polar surface area (TPSA) of 53.0 Ų, CCRIS 1749 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CCRIS 1749 has 2 hydrogen bond donor(s) and 3 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 CCRIS 1749?
The CAS number of CCRIS 1749 is 97170-08-6.
What is the molecular formula of CCRIS 1749?
The molecular formula of CCRIS 1749 is C19H16O3.
What is the molecular weight of CCRIS 1749?
The molecular weight of CCRIS 1749 is 292.11 g/mol.
Where can I buy CCRIS 1749?
You can request a quote for CCRIS 1749 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CCRIS 1749?
Yes, KEHONG BIO provides custom synthesis services for CCRIS 1749 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.