![N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide structure](/static/products/4497/449774-22-5.webp)
N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
TL;DR: N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide (CAS 449774-22-5) is a chemical compound with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
Also Known As: N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide, 2-methyl-N-(3-{[(naphthylcarbonylamino)thioxomethyl]amino}phenyl)propanamide, N-({3-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)naphthalene-1-carboxamide
| Molecular Formula | C22H21N3O2S |
|---|---|
| Molecular Weight | 391.14 g/mol |
| LogP | 4.5611 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.13544 |
| Heavy Atoms | 28 |
| Complexity | 1041.3911 |
Chemical Identifiers
| CAS Number | 449774-22-5 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32 |
Product Overview
N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide (CAS 449774-22-5), with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol. IUPAC: N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide.
Chemical Property Profile of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
Property Insights of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
The XLogP value of 4.5611 indicates that N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide. Following Lipinski's Rule of Five, N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide has 3 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-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The CAS number of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is 449774-22-5.
What is the molecular formula of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The molecular formula of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is C22H21N3O2S.
What is the molecular weight of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
The molecular weight of N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide is 391.14 g/mol.
Where can I buy N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
You can request a quote for N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.