TL;DR: Compound 183 (CAS 123148-90-3) is a chemical compound with molecular formula C10H13BrN4O3 and molecular weight 316.0171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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]-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H13BrN4O3 |
| Molecular Weight | 316.0171 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.0171 Da |
| Heavy Atoms | 18 |
| Complexity | 270.0 |
| SMILES | C1=C(C2=C(N=CN=C2N1COC(CO)CO)N)Br |
| InChIKey | QTMAZYGAVHCKKX-UHFFFAOYSA-N |
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.
The CAS number of Compound 183 is 123148-90-3.
The molecular formula of Compound 183 is C10H13BrN4O3.
The molecular weight of Compound 183 is 316.0171 g/mol.
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