Compound 183
TL;DR: Compound 183 (CAS 123148-90-3) is a chemical compound with molecular formula C10H13BrN4O3 and molecular weight 316.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-bromopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]propane-1,3-diol
Also Known As: Compound 183, 1,3-Propanediol, 2-((4-amino-5-bromo-7H-pyrrolo(2,3-d)pyrimidin-7-yl)methoxy)-, 2-[(4-amino-5-bromopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]prop, 2-[(4-amino-5-bromopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]propane-1,3-diol, 1,3-Propanediol, 2-[(4-amino-5-bromo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methoxy]-
| Molecular Formula | C10H13BrN4O3 |
|---|---|
| Molecular Weight | 316.02 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.0171 |
| Heavy Atoms | 18 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 123148-90-3 |
|---|---|
| SMILES | C1=C(C2=C(N=CN=C2N1COC(CO)CO)N)Br |
| InChIKey | QTMAZYGAVHCKKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Compound 183 (CAS 123148-90-3), with molecular formula C10H13BrN4O3 and molecular weight 316.02 g/mol. IUPAC: 2-[(4-amino-5-bromopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]propane-1,3-diol.
Chemical Property Profile of Compound 183
Property Insights of Compound 183
The XLogP value of -0.5 indicates that Compound 183 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Compound 183. Following Lipinski's Rule of Five, Compound 183 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 Compound 183?
The CAS number of Compound 183 is 123148-90-3.
What is the molecular formula of Compound 183?
The molecular formula of Compound 183 is C10H13BrN4O3.
What is the molecular weight of Compound 183?
The molecular weight of Compound 183 is 316.02 g/mol.
Where can I buy Compound 183?
You can request a quote for Compound 183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compound 183?
Yes, KEHONG BIO provides custom synthesis services for Compound 183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.