4-Cmtdm
TL;DR: 4-Cmtdm (CAS 131467-45-3) is a chemical compound with molecular formula C24H31FO7S and molecular weight 482.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid
Also Known As: 4-Cmtdm, 4-(Carboxymethylthio)dexamethasone, 4-(Carboxymethylthio)betamethasone, 2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid, (((11beta,16alpha)-9-Fluoro-11,17,21-trihydroxy-16-methyl-3,20-dioxopregn-1,4-dien-4-yl)thio)acetic acid
| Molecular Formula | C24H31FO7S |
|---|---|
| Molecular Weight | 482.18 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.17746 |
| Heavy Atoms | 33 |
| Complexity | 978.0 |
Chemical Identifiers
| CAS Number | 131467-45-3 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H]3CCC4=C(C(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C)SCC(=O)O |
| InChIKey | YNWPGLLPEDRZEY-AHAMZHHVSA-N |
Product Overview
4-Cmtdm (CAS 131467-45-3), with molecular formula C24H31FO7S and molecular weight 482.18 g/mol. IUPAC: 2-[[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-4-yl]sulfanyl]acetic acid.
Chemical Property Profile of 4-Cmtdm
Property Insights of 4-Cmtdm
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Cmtdm. The TPSA of 157.0 Ų indicates high polarity, suggesting 4-Cmtdm may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Cmtdm has 4 hydrogen bond donor(s) and 9 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 4-Cmtdm?
The CAS number of 4-Cmtdm is 131467-45-3.
What is the molecular formula of 4-Cmtdm?
The molecular formula of 4-Cmtdm is C24H31FO7S.
What is the molecular weight of 4-Cmtdm?
The molecular weight of 4-Cmtdm is 482.18 g/mol.
Where can I buy 4-Cmtdm?
You can request a quote for 4-Cmtdm directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cmtdm?
Yes, KEHONG BIO provides custom synthesis services for 4-Cmtdm and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.