IDI1_003476
TL;DR: IDI1_003476 (CAS 1164550-79-1) is a chemical compound with molecular formula C18H19N3O4 and molecular weight 341.13754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(1-benzylpyrazol-4-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: IDI1_003476, 3-[(1-benzyl-1H-pyrazol-4-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 2-[(1-benzylpyrazol-4-yl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid, 3-((1-benzyl-1H-pyrazol-4-yl)carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(1-BENZYLPYRAZOL-4-YL)CARBAMOYL]-7-OXABICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID
Technical Specifications
| Molecular Formula | C18H19N3O4 |
| Molecular Weight | 341.13754 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.13754 Da |
| Heavy Atoms | 25 |
| Complexity | 522.0 |
| SMILES | C1CC2C(C(C1O2)C(=O)NC3=CN(N=C3)CC4=CC=CC=C4)C(=O)O |
| InChIKey | SLVLJBWSJIGQQU-UHFFFAOYSA-N |
Chemical Property Profile of IDI1_003476
Property Insights of IDI1_003476
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IDI1_003476. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_003476. Following Lipinski's Rule of Five, IDI1_003476 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of IDI1_003476?
The CAS number of IDI1_003476 is 1164550-79-1.
What is the molecular formula of IDI1_003476?
The molecular formula of IDI1_003476 is C18H19N3O4.
What is the molecular weight of IDI1_003476?
The molecular weight of IDI1_003476 is 341.13754 g/mol.
Where can I buy IDI1_003476?
You can request a quote for IDI1_003476 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for IDI1_003476?
Yes, CoreyChem provides custom synthesis services for IDI1_003476 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.