AP-970/42249954
TL;DR: AP-970/42249954 (CAS 677295-09-9) is a chemical compound with molecular formula C18H19N3O2S2 and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Also Known As: AP-970/42249954, 2-[(3,5-dimethylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide, 2-({[(3,5-dimethylphenyl)carbonyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide, 2-({[(3,5-dimethylbenzoyl)amino]carbothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
| Molecular Formula | C18H19N3O2S2 |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | 3.07934 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.09186 |
| Heavy Atoms | 25 |
| Complexity | 866.4366 |
Chemical Identifiers
| CAS Number | 677295-09-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCC3)C(=O)N)C |
Product Overview
AP-970/42249954 (CAS 677295-09-9), with molecular formula C18H19N3O2S2 and molecular weight 373.09 g/mol. IUPAC: 2-[(3,5-dimethylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide.
Chemical Property Profile of AP-970/42249954
Property Insights of AP-970/42249954
The XLogP value of 3.07934 indicates that AP-970/42249954 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42249954. Following Lipinski's Rule of Five, AP-970/42249954 has 3 hydrogen bond donor(s) and 4 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 AP-970/42249954?
The CAS number of AP-970/42249954 is 677295-09-9.
What is the molecular formula of AP-970/42249954?
The molecular formula of AP-970/42249954 is C18H19N3O2S2.
What is the molecular weight of AP-970/42249954?
The molecular weight of AP-970/42249954 is 373.09 g/mol.
Where can I buy AP-970/42249954?
You can request a quote for AP-970/42249954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42249954?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42249954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.