RefChem:1058541
TL;DR: RefChem:1058541 (CAS 126936-20-7) is a chemical compound with molecular formula C17H20N4O and molecular weight 296.1637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(5,6,7,8-tetrahydronaphthalen-2-yl)urea
Also Known As: 1H-Pyrrole-2-carboxaldehyde, 1-methyl-4-(5,6,7,8-tetrahydro-2-naphthalenyl)semicarbazone, Semicarbazide, 4-(5,6,7,8-tetrahydro-2-naphthalenyl)-1-((1-methyl-2-pyrrolyl)methylene)-
Technical Specifications
| Molecular Formula | C17H20N4O |
| Molecular Weight | 296.1637 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 58.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.1637 Da |
| Heavy Atoms | 22 |
| Complexity | 411.0 |
| SMILES | CN1C=CC=C1/C=N/NC(=O)NC2=CC3=C(CCCC3)C=C2 |
| InChIKey | XXPFFMNLWRDWPD-LDADJPATSA-N |
Chemical Property Profile of RefChem:1058541
Property Insights of RefChem:1058541
The XLogP value of 3.0 indicates that RefChem:1058541 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.4 Ų, RefChem:1058541 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058541 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1058541?
The CAS number of RefChem:1058541 is 126936-20-7.
What is the molecular formula of RefChem:1058541?
The molecular formula of RefChem:1058541 is C17H20N4O.
What is the molecular weight of RefChem:1058541?
The molecular weight of RefChem:1058541 is 296.1637 g/mol.
Where can I buy RefChem:1058541?
You can request a quote for RefChem:1058541 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1058541?
Yes, CoreyChem provides custom synthesis services for RefChem:1058541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.