RefChem:1071634
TL;DR: RefChem:1071634 (CAS 84245-84-1) is a chemical compound with molecular formula C15H16N6O7S2 and molecular weight 456.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-2-methoxyimino-2-[2-[[4-[(Z)-N-methoxy-C-methoxycarbonylcarbonimidoyl]-1,3-thiazol-2-yl]carbamoylamino]-1,3-thiazol-4-yl]acetate
Also Known As: Dimethyl (Z,Z)-2,2'-(carboxyldiimino)bis(alpha-(methoxyimino)-4-thiazoleacetate), 4-Thiazoleacetic acid, 2,2'-(carboxyldiimino)bis(alpha-(methoxyimino)-, dimethyl ester, (Z,Z)-, RefChem:1071634
| Molecular Formula | C15H16N6O7S2 |
|---|---|
| Molecular Weight | 456.05 g/mol |
| LogP | 1.2906 |
| Topological Polar Surface Area | 162.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.0522 |
| Heavy Atoms | 30 |
| Complexity | 907.5436 |
Chemical Identifiers
| CAS Number | 84245-84-1 |
|---|---|
| SMILES | COC(=O)/C(=N\OC)/C1=CSC(=N1)NC(=O)NC2=NC(=CS2)/C(=N/OC)/C(=O)OC |
Product Overview
RefChem:1071634 (CAS 84245-84-1), with molecular formula C15H16N6O7S2 and molecular weight 456.05 g/mol. IUPAC: methyl (2Z)-2-methoxyimino-2-[2-[[4-[(Z)-N-methoxy-C-methoxycarbonylcarbonimidoyl]-1,3-thiazol-2-yl]carbamoylamino]-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of RefChem:1071634
Property Insights of RefChem:1071634
The XLogP value of 1.2906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1071634. The TPSA of 162.69 Ų indicates high polarity, suggesting RefChem:1071634 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1071634 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 RefChem:1071634?
The CAS number of RefChem:1071634 is 84245-84-1.
What is the molecular formula of RefChem:1071634?
The molecular formula of RefChem:1071634 is C15H16N6O7S2.
What is the molecular weight of RefChem:1071634?
The molecular weight of RefChem:1071634 is 456.05 g/mol.
Where can I buy RefChem:1071634?
You can request a quote for RefChem:1071634 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071634?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.