Opera_ID_100
TL;DR: Opera_ID_100 (CAS 345951-23-7) is a chemical compound with molecular formula C15H15N5O3 and molecular weight 313.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxo-1,4-dihydroimidazol-4-yl]acetic acid
Also Known As: [2-(4,6-Dimethyl-quinazolin-2-ylamino)-5-oxo-4,5-dihydro-1H-imidazol-4-yl]-acetic acid, 1016AE, BAS 01173882, BIM-0036809.P001, 2-(2-((4,6-Dimethylquinazolin-2-yl)amino)-5-oxo-4,5-dihydro-1H-imidazol-4-yl)acetic acid
| Molecular Formula | C15H15N5O3 |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 0.98764 |
| Topological Polar Surface Area | 116.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.1175 |
| Heavy Atoms | 23 |
| Complexity | 846.3664 |
Chemical Identifiers
| CAS Number | 345951-23-7 |
|---|---|
| SMILES | CC1=CC2=C(N=C(N=C2C=C1)NC3=NC(C(=O)N3)CC(=O)O)C |
Product Overview
Opera_ID_100 (CAS 345951-23-7), with molecular formula C15H15N5O3 and molecular weight 313.12 g/mol. IUPAC: 2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxo-1,4-dihydroimidazol-4-yl]acetic acid.
Chemical Property Profile of Opera_ID_100
Property Insights of Opera_ID_100
The XLogP value of 0.98764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Opera_ID_100. The TPSA of 116.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Opera_ID_100. Following Lipinski's Rule of Five, Opera_ID_100 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 Opera_ID_100?
The CAS number of Opera_ID_100 is 345951-23-7.
What is the molecular formula of Opera_ID_100?
The molecular formula of Opera_ID_100 is C15H15N5O3.
What is the molecular weight of Opera_ID_100?
The molecular weight of Opera_ID_100 is 313.12 g/mol.
Where can I buy Opera_ID_100?
You can request a quote for Opera_ID_100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Opera_ID_100?
Yes, KEHONG BIO provides custom synthesis services for Opera_ID_100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.