methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate
TL;DR: methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate (CAS 184174-80-9) is a chemical compound with molecular formula C9H11NO2S and molecular weight 197.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: methyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, 1-propyl-3-pyrrolidinamine, 2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester, methyl 2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate, s10368
| Molecular Formula | C9H11NO2S |
|---|---|
| Molecular Weight | 197.05 g/mol |
| LogP | 1.6056 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.05106 |
| Heavy Atoms | 13 |
| Complexity | 356.74182 |
Chemical Identifiers
| CAS Number | 184174-80-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCC2)N |
Product Overview
methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate (CAS 184174-80-9), with molecular formula C9H11NO2S and molecular weight 197.05 g/mol. IUPAC: methyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate
Property Insights of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate
The XLogP value of 1.6056 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate. With a topological polar surface area (TPSA) of 52.32 Ų, methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate has 1 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 methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate?
The CAS number of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate is 184174-80-9.
What is the molecular formula of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate?
The molecular formula of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate is C9H11NO2S.
What is the molecular weight of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate?
The molecular weight of methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate is 197.05 g/mol.
Where can I buy methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate?
You can request a quote for methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-amino-4H,5H,6H-cyclopenta(b)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.