Propan-2-yl 4-(quinazolin-4-ylamino)benzoate
TL;DR: Propan-2-yl 4-(quinazolin-4-ylamino)benzoate (CAS 510737-65-2) is a chemical compound with molecular formula C18H17N3O2 and molecular weight 307.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(quinazolin-4-ylamino)benzoate
Also Known As: propan-2-yl 4-(quinazolin-4-ylamino)benzoate, 1-Methylethyl 4-(4-quinazolinylamino)benzoate, SDCCGSBI-0661342.P001, BAS 05172442, isopropyl 4-(4-quinazolinylamino)benzoate
| Molecular Formula | C18H17N3O2 |
|---|---|
| Molecular Weight | 307.13 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.13208 |
| Heavy Atoms | 23 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 510737-65-2 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC=C(C=C1)NC2=NC=NC3=CC=CC=C32 |
| InChIKey | CUTRHYHJQOXCDN-UHFFFAOYSA-N |
Product Overview
Propan-2-yl 4-(quinazolin-4-ylamino)benzoate (CAS 510737-65-2), with molecular formula C18H17N3O2 and molecular weight 307.13 g/mol. IUPAC: propan-2-yl 4-(quinazolin-4-ylamino)benzoate.
Chemical Property Profile of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate
Property Insights of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate
The XLogP value of 4.6 indicates that Propan-2-yl 4-(quinazolin-4-ylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Propan-2-yl 4-(quinazolin-4-ylamino)benzoate. Following Lipinski's Rule of Five, Propan-2-yl 4-(quinazolin-4-ylamino)benzoate has 1 hydrogen bond donor(s) and 5 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 Propan-2-yl 4-(quinazolin-4-ylamino)benzoate?
The CAS number of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate is 510737-65-2.
What is the molecular formula of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate?
The molecular formula of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate is C18H17N3O2.
What is the molecular weight of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate?
The molecular weight of Propan-2-yl 4-(quinazolin-4-ylamino)benzoate is 307.13 g/mol.
Where can I buy Propan-2-yl 4-(quinazolin-4-ylamino)benzoate?
You can request a quote for Propan-2-yl 4-(quinazolin-4-ylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl 4-(quinazolin-4-ylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl 4-(quinazolin-4-ylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.