BAS 12769559
TL;DR: BAS 12769559 (CAS 878424-65-8) is a chemical compound with molecular formula C21H17N5O3 and molecular weight 387.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenylpyrrolo[3,4-d]pyrimidine-2,4-dione
Also Known As: BAS 12769559, 1,3-dimethyl-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenylpyrrolo[3,4-d]pyrimidine-2,4-dione, 1,3-DIMETHYL-6-(2-OXO-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-5-YL)-5-PHENYL-1H,2H,3H,4H,6H-PYRROLO[3,4-D]PYRIMIDINE-2,4-DIONE, 1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 1,3-dimethyl-6-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-5-yl)-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
| Molecular Formula | C21H17N5O3 |
|---|---|
| Molecular Weight | 387.13 g/mol |
| LogP | 1.8645 |
| Topological Polar Surface Area | 97.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 387.13315 |
| Heavy Atoms | 29 |
| Complexity | 1578.7164 |
Chemical Identifiers
| CAS Number | 878424-65-8 |
|---|---|
| SMILES | CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=CC=C3)C4=CC5=C(C=C4)NC(=O)N5 |
Product Overview
BAS 12769559 (CAS 878424-65-8), with molecular formula C21H17N5O3 and molecular weight 387.13 g/mol. IUPAC: 1,3-dimethyl-6-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenylpyrrolo[3,4-d]pyrimidine-2,4-dione.
Chemical Property Profile of BAS 12769559
Property Insights of BAS 12769559
The XLogP value of 1.8645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12769559. The TPSA of 97.58 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12769559. Following Lipinski's Rule of Five, BAS 12769559 has 2 hydrogen bond donor(s) and 3 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 BAS 12769559?
The CAS number of BAS 12769559 is 878424-65-8.
What is the molecular formula of BAS 12769559?
The molecular formula of BAS 12769559 is C21H17N5O3.
What is the molecular weight of BAS 12769559?
The molecular weight of BAS 12769559 is 387.13 g/mol.
Where can I buy BAS 12769559?
You can request a quote for BAS 12769559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12769559?
Yes, KEHONG BIO provides custom synthesis services for BAS 12769559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.