吲哚丙醇磷酸酯
TL;DR: 吲哚丙醇磷酸酯 (CAS 40716-80-1) is a chemical compound with molecular formula C11H14NO4P and molecular weight 255.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吲哚丙醇磷酸酯
3-(1H-indol-3-yl)propyl dihydrogen phosphate
Also Known As: Indolepropanol phosphate, indole-3-propanol phosphate, Indole propanol phosphate, 3-(1H-indol-3-yl)propyl dihydrogen phosphate, 3-(indol-3-yl)propyl phosphate
| Molecular Formula | C11H14NO4P |
|---|---|
| Molecular Weight | 255.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.06604 |
| Heavy Atoms | 17 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 40716-80-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCCOP(=O)(O)O |
| InChIKey | NKEZSFZOUIIZFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吲哚丙醇磷酸酯 (CAS 40716-80-1), with molecular formula C11H14NO4P and molecular weight 255.07 g/mol. IUPAC: 3-(1H-indol-3-yl)propyl dihydrogen phosphate.
Chemical Property Profile of 吲哚丙醇磷酸酯
Property Insights of 吲哚丙醇磷酸酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吲哚丙醇磷酸酯. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 吲哚丙醇磷酸酯. Following Lipinski's Rule of Five, 1H-吲哚-3-丙醇-3-磷酸二氢酯 has 3 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 1H-吲哚-3-丙醇-3-磷酸二氢酯?
The CAS number of 1H-吲哚-3-丙醇-3-磷酸二氢酯 is 40716-80-1.
What is the molecular formula of 1H-吲哚-3-丙醇-3-磷酸二氢酯?
The molecular formula of 1H-吲哚-3-丙醇-3-磷酸二氢酯 is C11H14NO4P.
What is the molecular weight of 1H-吲哚-3-丙醇-3-磷酸二氢酯?
The molecular weight of 1H-吲哚-3-丙醇-3-磷酸二氢酯 is 255.07 g/mol.
Where can I buy 1H-吲哚-3-丙醇-3-磷酸二氢酯?
You can request a quote for 1H-吲哚-3-丙醇-3-磷酸二氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-吲哚-3-丙醇-3-磷酸二氢酯?
Yes, KEHONG BIO provides custom synthesis services for 1H-吲哚-3-丙醇-3-磷酸二氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.