6-Bromotoyocamycin
TL;DR: 6-Bromotoyocamycin (CAS 20286-82-2) is a chemical compound with molecular formula C12H12BrN5O4 and molecular weight 369.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Also Known As: 6-Bromotoyocamycin, 4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 4-amino-6-bromo-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine-5-carbonitrile, (S)-4-Amino-6-bromo-7-((3R,4S,5R)-3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-7,7a-dihydro-4aH-pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[5,4-d]pyrimidine-5-carbonitrile
| Molecular Formula | C12H12BrN5O4 |
|---|---|
| Molecular Weight | 369.01 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.00726 |
| Heavy Atoms | 22 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 20286-82-2 |
|---|---|
| SMILES | C1=NC(=C2C(=C(N(C2=N1)C3C(C(C(O3)CO)O)O)Br)C#N)N |
| InChIKey | VGLVPHRWFSFJJL-UHFFFAOYSA-N |
Product Overview
6-Bromotoyocamycin (CAS 20286-82-2), with molecular formula C12H12BrN5O4 and molecular weight 369.01 g/mol. IUPAC: 4-amino-6-bromo-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile.
Chemical Property Profile of 6-Bromotoyocamycin
Property Insights of 6-Bromotoyocamycin
The XLogP value of -0.6 indicates that 6-Bromotoyocamycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.0 Ų indicates high polarity, suggesting 6-Bromotoyocamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Bromotoyocamycin has 4 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 6-Bromotoyocamycin?
The CAS number of 6-Bromotoyocamycin is 20286-82-2.
What is the molecular formula of 6-Bromotoyocamycin?
The molecular formula of 6-Bromotoyocamycin is C12H12BrN5O4.
What is the molecular weight of 6-Bromotoyocamycin?
The molecular weight of 6-Bromotoyocamycin is 369.01 g/mol.
Where can I buy 6-Bromotoyocamycin?
You can request a quote for 6-Bromotoyocamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromotoyocamycin?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromotoyocamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.