N-tert-butyl-2-oxo-2H-chromene-3-carboxamide
TL;DR: N-tert-butyl-2-oxo-2H-chromene-3-carboxamide (CAS 219139-66-9) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-oxochromene-3-carboxamide
Also Known As: Maybridge3_000160, IDI1_011547, N-tert-butyl-2-oxochromene-3-carboxamide, N-(tert-butyl)(2-oxochromen-3-yl)carboxamide, N-tert-butyl-2-oxo-2H-chromene-3-carboxamide
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.3213 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 649.8721 |
Chemical Identifiers
| CAS Number | 219139-66-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=CC2=CC=CC=C2OC1=O |
Product Overview
N-tert-butyl-2-oxo-2H-chromene-3-carboxamide (CAS 219139-66-9), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: N-tert-butyl-2-oxochromene-3-carboxamide.
Chemical Property Profile of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide
Property Insights of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide
The XLogP value of 2.3213 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-2-oxo-2H-chromene-3-carboxamide. With a topological polar surface area (TPSA) of 59.31 Ų, N-tert-butyl-2-oxo-2H-chromene-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-2-oxo-2H-chromene-3-carboxamide has 1 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 N-tert-butyl-2-oxo-2H-chromene-3-carboxamide?
The CAS number of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide is 219139-66-9.
What is the molecular formula of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide?
The molecular formula of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide is C14H15NO3.
What is the molecular weight of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide?
The molecular weight of N-tert-butyl-2-oxo-2H-chromene-3-carboxamide is 245.11 g/mol.
Where can I buy N-tert-butyl-2-oxo-2H-chromene-3-carboxamide?
You can request a quote for N-tert-butyl-2-oxo-2H-chromene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-2-oxo-2H-chromene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2-oxo-2H-chromene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.