![2-({[(e)-phenylmethylidene]amino}methyl)phenol structure](/static/products/1329/132933-15-4.webp)
2-({[(e)-phenylmethylidene]amino}methyl)phenol
TL;DR: 2-({[(e)-phenylmethylidene]amino}methyl)phenol (CAS 132933-15-4) is a chemical compound with molecular formula C17H21N3O3 and molecular weight 315.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(11-methyl-2-oxo-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-10-yl)methyl]prop-2-enoate
Also Known As: 2-({[(e)-phenylmethylidene]amino}methyl)phenol, ethyl 2-[[methyl(oxo)[?]yl]methyl]prop-2-enoate, Imidazo(4,5,1-jk)(1,4)benzodiazepine-6(7H)-propanoic acid, 1,2,4,5-tetrahydro-5-methyl-alpha-methylene-2-oxo-, ethyl ester, 6-(2-Ethoxycarbonyl-propen-3-yl)-4,5,6,7-tetrahydro-5-methylimidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, (+/-)-6-(2-Ethoxycarbonyl-propen-3-yl)-4,5,6,7-tetrahydro-5-methylimidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one
| Molecular Formula | C17H21N3O3 |
|---|---|
| Molecular Weight | 315.16 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 61.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.1583 |
| Heavy Atoms | 23 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 132933-15-4 |
|---|---|
| SMILES | CCOC(=O)C(=C)CN1CC2=C3C(=CC=C2)NC(=O)N3CC1C |
| InChIKey | BGNNXDORPMXXML-UHFFFAOYSA-N |
Product Overview
2-({[(e)-phenylmethylidene]amino}methyl)phenol (CAS 132933-15-4), with molecular formula C17H21N3O3 and molecular weight 315.16 g/mol. IUPAC: ethyl 2-[(11-methyl-2-oxo-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-10-yl)methyl]prop-2-enoate.
Chemical Property Profile of 2-({[(e)-phenylmethylidene]amino}methyl)phenol
Property Insights of 2-({[(e)-phenylmethylidene]amino}methyl)phenol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({[(e)-phenylmethylidene]amino}methyl)phenol. The TPSA of 61.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[(e)-phenylmethylidene]amino}methyl)phenol. Following Lipinski's Rule of Five, 2-({[(e)-phenylmethylidene]amino}methyl)phenol has 1 hydrogen bond donor(s) and 4 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 2-({[(e)-phenylmethylidene]amino}methyl)phenol?
The CAS number of 2-({[(e)-phenylmethylidene]amino}methyl)phenol is 132933-15-4.
What is the molecular formula of 2-({[(e)-phenylmethylidene]amino}methyl)phenol?
The molecular formula of 2-({[(e)-phenylmethylidene]amino}methyl)phenol is C17H21N3O3.
What is the molecular weight of 2-({[(e)-phenylmethylidene]amino}methyl)phenol?
The molecular weight of 2-({[(e)-phenylmethylidene]amino}methyl)phenol is 315.16 g/mol.
Where can I buy 2-({[(e)-phenylmethylidene]amino}methyl)phenol?
You can request a quote for 2-({[(e)-phenylmethylidene]amino}methyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[(e)-phenylmethylidene]amino}methyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-({[(e)-phenylmethylidene]amino}methyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.