Mdatmc
TL;DR: Mdatmc (CAS 137778-06-4) is a chemical compound with molecular formula C21H21N5O8S2 and molecular weight 535.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-prop-1-en-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: Mdatmc, (5-Methyl-2-oxo-1,3-dioxolen-4-yl)methyl 7-(2-(2-amino-4-thiazole)-2-methoxyiminoacetamido)-3-(2-propenyl)-3-cephem-4-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-prop-1-en-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, (5-methyl-2-oxo-1,3-dioxolen-4-yl)methyl 7-(2-(2-amino-4-thiazole)-2-methoxyiminoacetamido)-3-(2-pro, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-3-(1-methylethenyl)-8-oxo-, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, (6R-(6alpha,7beta(Z)))-
| Molecular Formula | C21H21N5O8S2 |
|---|---|
| Molecular Weight | 535.08 g/mol |
| LogP | 0.90392 |
| Topological Polar Surface Area | 179.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.0831 |
| Heavy Atoms | 36 |
| Complexity | 1370.2073 |
Chemical Identifiers
| CAS Number | 137778-06-4 |
|---|---|
| SMILES | CC1=C(OC(=O)O1)COC(=O)C2=C(CS[C@H]3N2C(=O)[C@H]3NC(=O)/C(=N/OC)/C4=CSC(=N4)N)C(=C)C |
Product Overview
Mdatmc (CAS 137778-06-4), with molecular formula C21H21N5O8S2 and molecular weight 535.08 g/mol. IUPAC: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-prop-1-en-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of Mdatmc
Property Insights of Mdatmc
The XLogP value of 0.90392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mdatmc. The TPSA of 179.56 Ų indicates high polarity, suggesting Mdatmc may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mdatmc has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mdatmc?
The CAS number of Mdatmc is 137778-06-4.
What is the molecular formula of Mdatmc?
The molecular formula of Mdatmc is C21H21N5O8S2.
What is the molecular weight of Mdatmc?
The molecular weight of Mdatmc is 535.08 g/mol.
Where can I buy Mdatmc?
You can request a quote for Mdatmc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mdatmc?
Yes, KEHONG BIO provides custom synthesis services for Mdatmc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.