Attophos
TL;DR: Attophos (CAS 129058-45-3) is a chemical compound with molecular formula C14H9N2O4PS2 and molecular weight 363.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1,3-benzothiazol-2-yl)-1,3-benzothiazol-6-yl] dihydrogen phosphate
Also Known As: Attophos, BBTP, 6-(Phosphonooxy)-2,2 -bibenzothiazole, 2,2 -Bi[benzothiazole]-6-ol phosphate, 2,2'-bi-1,3-benzothiazol-6-yl dihydrogen phosphate
| Molecular Formula | C14H9N2O4PS2 |
|---|---|
| Molecular Weight | 363.97 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.97412 |
| Heavy Atoms | 23 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 129058-45-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=NC4=C(S3)C=C(C=C4)OP(=O)(O)O |
| InChIKey | BTKMJKKKZATLBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Attophos (CAS 129058-45-3), with molecular formula C14H9N2O4PS2 and molecular weight 363.97 g/mol. IUPAC: [2-(1,3-benzothiazol-2-yl)-1,3-benzothiazol-6-yl] dihydrogen phosphate.
Chemical Property Profile of Attophos
Property Insights of Attophos
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Attophos. The TPSA of 149.0 Ų indicates high polarity, suggesting Attophos may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Attophos has 2 hydrogen bond donor(s) and 8 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 Attophos?
The CAS number of Attophos is 129058-45-3.
What is the molecular formula of Attophos?
The molecular formula of Attophos is C14H9N2O4PS2.
What is the molecular weight of Attophos?
The molecular weight of Attophos is 363.97 g/mol.
Where can I buy Attophos?
You can request a quote for Attophos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Attophos?
Yes, KEHONG BIO provides custom synthesis services for Attophos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.