AB00675706-01
TL;DR: AB00675706-01 (CAS 1009262-31-0) is a chemical compound with molecular formula C25H25N3O4S and molecular weight 463.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-2-[[2-(12-oxo-10,13-diazatricyclo[7.4.1.05,14]tetradeca-1,3,5(14),6,8-pentaen-11-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AB00675706-01, F1709-0028, methyl 6-methyl-2-(2-{12-oxo-10,13-diazatricyclo[7.4.1.0^{5,14}]tetradeca-1,3,5(14),6,8-pentaen-11-yl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-methyl-2-{[(3-oxo-1,2,3,4-tetrahydronaphtho[1,8-ef][1,4]diazepin-2-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 6-methyl-2-[[2-(12-oxo-10,13-diazatricyclo[7.4.1.05,14]tetradeca-1,3,5(14),6,8-pentaen-11-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C25H25N3O4S |
|---|---|
| Molecular Weight | 463.16 g/mol |
| LogP | 4.5741 |
| Topological Polar Surface Area | 96.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.1566 |
| Heavy Atoms | 33 |
| Complexity | 1276.8878 |
Chemical Identifiers
| CAS Number | 1009262-31-0 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CC3C(=O)NC4=CC=CC5=C4C(=CC=C5)N3 |
Product Overview
AB00675706-01 (CAS 1009262-31-0), with molecular formula C25H25N3O4S and molecular weight 463.16 g/mol. IUPAC: methyl 6-methyl-2-[[2-(12-oxo-10,13-diazatricyclo[7.4.1.05,14]tetradeca-1,3,5(14),6,8-pentaen-11-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AB00675706-01
Property Insights of AB00675706-01
The XLogP value of 4.5741 indicates that AB00675706-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00675706-01. Following Lipinski's Rule of Five, AB00675706-01 has 3 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 AB00675706-01?
The CAS number of AB00675706-01 is 1009262-31-0.
What is the molecular formula of AB00675706-01?
The molecular formula of AB00675706-01 is C25H25N3O4S.
What is the molecular weight of AB00675706-01?
The molecular weight of AB00675706-01 is 463.16 g/mol.
Where can I buy AB00675706-01?
You can request a quote for AB00675706-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00675706-01?
Yes, KEHONG BIO provides custom synthesis services for AB00675706-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.