AB00715209-01
TL;DR: AB00715209-01 (CAS 371232-08-5) is a chemical compound with molecular formula C27H31N5O3S and molecular weight 505.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-amino-1-hexylpyrrolo[3,2-b]quinoxaline-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AB00715209-01, methyl 2-{[(2-amino-1-hexyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-(2-amino-1-hexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-[(2-amino-1-hexylpyrrolo[3,2-b]quinoxaline-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C27H31N5O3S |
|---|---|
| Molecular Weight | 505.21 g/mol |
| LogP | 5.7262 |
| Topological Polar Surface Area | 112.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.21475 |
| Heavy Atoms | 36 |
| Complexity | 1455.158 |
Chemical Identifiers
| CAS Number | 371232-08-5 |
|---|---|
| SMILES | CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC)N |
Product Overview
AB00715209-01 (CAS 371232-08-5), with molecular formula C27H31N5O3S and molecular weight 505.21 g/mol. IUPAC: methyl 2-[(2-amino-1-hexylpyrrolo[3,2-b]quinoxaline-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AB00715209-01
Property Insights of AB00715209-01
The XLogP value of 5.7262 indicates that AB00715209-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00715209-01. Following Lipinski's Rule of Five, AB00715209-01 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00715209-01?
The CAS number of AB00715209-01 is 371232-08-5.
What is the molecular formula of AB00715209-01?
The molecular formula of AB00715209-01 is C27H31N5O3S.
What is the molecular weight of AB00715209-01?
The molecular weight of AB00715209-01 is 505.21 g/mol.
Where can I buy AB00715209-01?
You can request a quote for AB00715209-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00715209-01?
Yes, KEHONG BIO provides custom synthesis services for AB00715209-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.