CM 037
TL;DR: CM 037 (CAS 896795-60-1) is a chemical compound with molecular formula C21H25N3O3S2 and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[4-oxo-3-(3-pyrrolidin-1-ylpropyl)-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetate
Also Known As: CM 037, A-37, J3.397.091I, A37, Ethyl ({4-Oxo-3-[3-(Pyrrolidin-1-Yl)propyl]-3,4-Dihydro[1]benzothieno[3,2-D]pyrimidin-2-Yl}sulfanyl)acetate
| Molecular Formula | C21H25N3O3S2 |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 3.7523 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 431.13373 |
| Heavy Atoms | 29 |
| Complexity | 1070.1447 |
Chemical Identifiers
| CAS Number | 896795-60-1 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C(=O)N1CCCN3CCCC3)SC4=CC=CC=C42 |
Product Overview
CM 037 (CAS 896795-60-1), with molecular formula C21H25N3O3S2 and molecular weight 431.13 g/mol. IUPAC: ethyl 2-[[4-oxo-3-(3-pyrrolidin-1-ylpropyl)-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetate.
Chemical Property Profile of CM 037
Property Insights of CM 037
The XLogP value of 3.7523 indicates that CM 037 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for CM 037. Following Lipinski's Rule of Five, CM 037 has 0 hydrogen bond donor(s) and 7 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 CM 037?
The CAS number of CM 037 is 896795-60-1.
What is the molecular formula of CM 037?
The molecular formula of CM 037 is C21H25N3O3S2.
What is the molecular weight of CM 037?
The molecular weight of CM 037 is 431.13 g/mol.
Where can I buy CM 037?
You can request a quote for CM 037 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CM 037?
Yes, KEHONG BIO provides custom synthesis services for CM 037 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.