AB00673838-01
TL;DR: AB00673838-01 (CAS 887900-47-2) is a chemical compound with molecular formula C18H21BrN2O3S2 and molecular weight 456.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(5-bromothiophene-2-carbonyl)amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
Also Known As: AB00673838-01, F1299-0134, methyl 2-(5-bromothiophene-2-amido)-5,5,7,7-tetramethyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 2-(5-bromothiophene-2-carboxamido)-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, methyl 2-[(5-bromothiophene-2-carbonyl)amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C18H21BrN2O3S2 |
|---|---|
| Molecular Weight | 456.02 g/mol |
| LogP | 4.7704 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.0177 |
| Heavy Atoms | 26 |
| Complexity | 883.1284 |
Chemical Identifiers
| CAS Number | 887900-47-2 |
|---|---|
| SMILES | CC1(CC2=C(C(N1)(C)C)SC(=C2C(=O)OC)NC(=O)C3=CC=C(S3)Br)C |
Product Overview
AB00673838-01 (CAS 887900-47-2), with molecular formula C18H21BrN2O3S2 and molecular weight 456.02 g/mol. IUPAC: methyl 2-[(5-bromothiophene-2-carbonyl)amino]-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of AB00673838-01
Property Insights of AB00673838-01
The XLogP value of 4.7704 indicates that AB00673838-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00673838-01. Following Lipinski's Rule of Five, AB00673838-01 has 2 hydrogen bond donor(s) and 6 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 AB00673838-01?
The CAS number of AB00673838-01 is 887900-47-2.
What is the molecular formula of AB00673838-01?
The molecular formula of AB00673838-01 is C18H21BrN2O3S2.
What is the molecular weight of AB00673838-01?
The molecular weight of AB00673838-01 is 456.02 g/mol.
Where can I buy AB00673838-01?
You can request a quote for AB00673838-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673838-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673838-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.