A2623/0111612
TL;DR: A2623/0111612 (CAS 305375-77-3) is a chemical compound with molecular formula C17H16BrNO3S and molecular weight 393.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-bromobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: A2623/0111612, METHYL 2-(3-BROMOBENZAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-(3-bromobenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-[(3-bromophenyl)carbonylamino]-4,5,6,7-tetrahydrobenzo[b]thiophene-3- carboxylate, methyl 2-{[(3-bromophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C17H16BrNO3S |
|---|---|
| Molecular Weight | 393.00 g/mol |
| LogP | 4.4283 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.00342 |
| Heavy Atoms | 23 |
| Complexity | 769.19415 |
Chemical Identifiers
| CAS Number | 305375-77-3 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=CC=C3)Br |
Product Overview
A2623/0111612 (CAS 305375-77-3), with molecular formula C17H16BrNO3S and molecular weight 393.00 g/mol. IUPAC: methyl 2-[(3-bromobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of A2623/0111612
Property Insights of A2623/0111612
The XLogP value of 4.4283 indicates that A2623/0111612 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, A2623/0111612 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2623/0111612 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 A2623/0111612?
The CAS number of A2623/0111612 is 305375-77-3.
What is the molecular formula of A2623/0111612?
The molecular formula of A2623/0111612 is C17H16BrNO3S.
What is the molecular weight of A2623/0111612?
The molecular weight of A2623/0111612 is 393.00 g/mol.
Where can I buy A2623/0111612?
You can request a quote for A2623/0111612 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2623/0111612?
Yes, KEHONG BIO provides custom synthesis services for A2623/0111612 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.