2-(1H-indol-3-ylmethyl)propanediamide
TL;DR: 2-(1H-indol-3-ylmethyl)propanediamide (CAS 53215-63-7) is a chemical compound with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-ylmethyl)propanediamide
Also Known As: 2-(1H-indol-3-ylmethyl)propanediamide, (3-Indolylmethyl)malonamide, 3-Indolylmethylmalonsaeurediamid, 2-[(1H-Indol-3-yl)methyl]propanediamide, Propanediamide, 2-(1H-indol-3-ylmethyl)-
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 53215-63-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC(C(=O)N)C(=O)N |
| InChIKey | GFOWQANQLXTSJL-UHFFFAOYSA-N |
Product Overview
2-(1H-indol-3-ylmethyl)propanediamide (CAS 53215-63-7), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: 2-(1H-indol-3-ylmethyl)propanediamide.
Chemical Property Profile of 2-(1H-indol-3-ylmethyl)propanediamide
Property Insights of 2-(1H-indol-3-ylmethyl)propanediamide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-indol-3-ylmethyl)propanediamide. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-indol-3-ylmethyl)propanediamide. Following Lipinski's Rule of Five, 2-(1H-indol-3-ylmethyl)propanediamide has 3 hydrogen bond donor(s) and 2 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-(1H-indol-3-ylmethyl)propanediamide?
The CAS number of 2-(1H-indol-3-ylmethyl)propanediamide is 53215-63-7.
What is the molecular formula of 2-(1H-indol-3-ylmethyl)propanediamide?
The molecular formula of 2-(1H-indol-3-ylmethyl)propanediamide is C12H13N3O2.
What is the molecular weight of 2-(1H-indol-3-ylmethyl)propanediamide?
The molecular weight of 2-(1H-indol-3-ylmethyl)propanediamide is 231.10 g/mol.
Where can I buy 2-(1H-indol-3-ylmethyl)propanediamide?
You can request a quote for 2-(1H-indol-3-ylmethyl)propanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-indol-3-ylmethyl)propanediamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-indol-3-ylmethyl)propanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.