N-heptan-2-yl-9H-xanthene-9-carboxamide
TL;DR: N-heptan-2-yl-9H-xanthene-9-carboxamide (CAS 438457-27-3) is a chemical compound with molecular formula C21H25NO2 and molecular weight 323.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-heptan-2-yl-9H-xanthene-9-carboxamide
Also Known As: N-heptan-2-yl-9H-xanthene-9-carboxamide, N-(methylhexyl)xanthen-9-ylcarboxamide, N-(heptan-2-yl)-9H-xanthene-9-carboxamide, N-(1-methylhexyl)-9H-xanthene-9-carboxamide
| Molecular Formula | C21H25NO2 |
|---|---|
| Molecular Weight | 323.19 g/mol |
| LogP | 5.0092 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.18854 |
| Heavy Atoms | 24 |
| Complexity | 664.98987 |
Chemical Identifiers
| CAS Number | 438457-27-3 |
|---|---|
| SMILES | CCCCCC(C)NC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13 |
Product Overview
N-heptan-2-yl-9H-xanthene-9-carboxamide (CAS 438457-27-3), with molecular formula C21H25NO2 and molecular weight 323.19 g/mol. IUPAC: N-heptan-2-yl-9H-xanthene-9-carboxamide.
Chemical Property Profile of N-heptan-2-yl-9H-xanthene-9-carboxamide
Property Insights of N-heptan-2-yl-9H-xanthene-9-carboxamide
The XLogP value of 5.0092 indicates that N-heptan-2-yl-9H-xanthene-9-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, N-heptan-2-yl-9H-xanthene-9-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-heptan-2-yl-9H-xanthene-9-carboxamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-heptan-2-yl-9H-xanthene-9-carboxamide?
The CAS number of N-heptan-2-yl-9H-xanthene-9-carboxamide is 438457-27-3.
What is the molecular formula of N-heptan-2-yl-9H-xanthene-9-carboxamide?
The molecular formula of N-heptan-2-yl-9H-xanthene-9-carboxamide is C21H25NO2.
What is the molecular weight of N-heptan-2-yl-9H-xanthene-9-carboxamide?
The molecular weight of N-heptan-2-yl-9H-xanthene-9-carboxamide is 323.19 g/mol.
Where can I buy N-heptan-2-yl-9H-xanthene-9-carboxamide?
You can request a quote for N-heptan-2-yl-9H-xanthene-9-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-heptan-2-yl-9H-xanthene-9-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-heptan-2-yl-9H-xanthene-9-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.