ASN 02054052
TL;DR: ASN 02054052 (CAS 332950-13-7) is a chemical compound with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: ASN 02054052, BRD-K44804853-001-01-4, ETHYL 2-{3-AMINO-4,6-DIMETHYLTHIENO[2,3-B]PYRIDINE-2-AMIDO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-[(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-{[(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C21H23N3O3S2 |
|---|---|
| Molecular Weight | 429.12 g/mol |
| LogP | 4.86464 |
| Topological Polar Surface Area | 94.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.11807 |
| Heavy Atoms | 29 |
| Complexity | 1130.3319 |
Chemical Identifiers
| CAS Number | 332950-13-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C4=C(S3)N=C(C=C4C)C)N |
Product Overview
ASN 02054052 (CAS 332950-13-7), with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol. IUPAC: ethyl 2-[(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of ASN 02054052
Property Insights of ASN 02054052
The XLogP value of 4.86464 indicates that ASN 02054052 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.31 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 02054052. Following Lipinski's Rule of Five, ASN 02054052 has 2 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 ASN 02054052?
The CAS number of ASN 02054052 is 332950-13-7.
What is the molecular formula of ASN 02054052?
The molecular formula of ASN 02054052 is C21H23N3O3S2.
What is the molecular weight of ASN 02054052?
The molecular weight of ASN 02054052 is 429.12 g/mol.
Where can I buy ASN 02054052?
You can request a quote for ASN 02054052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 02054052?
Yes, KEHONG BIO provides custom synthesis services for ASN 02054052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.