ASN 05445471
TL;DR: ASN 05445471 (CAS 601509-57-3) is a chemical compound with molecular formula C25H27ClN6OS and molecular weight 494.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-methyl-1-phenylpyrazole-4-carboxamide
Also Known As: ASN 05445471, 1H-PYRAZOLE-4-CARBOXAMIDE, 5-CHLORO-N-[2-[(2-ETHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4-YL)AMINO]ETHYL]-3-METHYL-1-PHENYL-, 5-chloro-N-[2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-methyl-1-phenylpyrazole-4-carboxamide
| Molecular Formula | C25H27ClN6OS |
|---|---|
| Molecular Weight | 494.17 g/mol |
| LogP | 5.12192 |
| Topological Polar Surface Area | 84.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.16556 |
| Heavy Atoms | 34 |
| Complexity | 1346.9469 |
Chemical Identifiers
| CAS Number | 601509-57-3 |
|---|---|
| SMILES | CCC1=NC(=C2C3=C(CCCC3)SC2=N1)NCCNC(=O)C4=C(N(N=C4C)C5=CC=CC=C5)Cl |
Product Overview
ASN 05445471 (CAS 601509-57-3), with molecular formula C25H27ClN6OS and molecular weight 494.17 g/mol. IUPAC: 5-chloro-N-[2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-methyl-1-phenylpyrazole-4-carboxamide.
Chemical Property Profile of ASN 05445471
Property Insights of ASN 05445471
The XLogP value of 5.12192 indicates that ASN 05445471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.73 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 05445471. Following Lipinski's Rule of Five, ASN 05445471 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 05445471?
The CAS number of ASN 05445471 is 601509-57-3.
What is the molecular formula of ASN 05445471?
The molecular formula of ASN 05445471 is C25H27ClN6OS.
What is the molecular weight of ASN 05445471?
The molecular weight of ASN 05445471 is 494.17 g/mol.
Where can I buy ASN 05445471?
You can request a quote for ASN 05445471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05445471?
Yes, KEHONG BIO provides custom synthesis services for ASN 05445471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.