4-(1H-吲哚-3-基)丁-1-胺
TL;DR: 4-(1H-吲哚-3-基)丁-1-胺 (CAS 669-70-5) is a chemical compound with molecular formula C12H16N2 and molecular weight 188.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1H-吲哚-3-基)丁-1-胺
4-(1H-indol-3-yl)butan-1-amine
Also Known As: 4-(1H-indol-3-yl)butan-1-amine, 3-(aminobutyl)indole, 1H-Indole-3-butanamine, Butylamine, 4-[3-indolyl]-, 3-(4-Aminobutyl)-1H-indole
| Molecular Formula | C12H16N2 |
|---|---|
| Molecular Weight | 188.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 188.13135 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 669-70-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCCCN |
| InChIKey | GZQBGZWAALHNBW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(1H-吲哚-3-基)丁-1-胺 (CAS 669-70-5), with molecular formula C12H16N2 and molecular weight 188.13 g/mol. IUPAC: 4-(1H-indol-3-yl)butan-1-amine.
Chemical Property Profile of 4-(1H-吲哚-3-基)丁-1-胺
Property Insights of 4-(1H-吲哚-3-基)丁-1-胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1H-吲哚-3-基)丁-1-胺. With a topological polar surface area (TPSA) of 41.8 Ų, 4-(1H-吲哚-3-基)丁-1-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1H-吲哚-3-基)丁-1-胺 has 2 hydrogen bond donor(s) and 1 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 4-(1H-吲哚-3-基)丁-1-胺?
The CAS number of 4-(1H-吲哚-3-基)丁-1-胺 is 669-70-5.
What is the molecular formula of 4-(1H-吲哚-3-基)丁-1-胺?
The molecular formula of 4-(1H-吲哚-3-基)丁-1-胺 is C12H16N2.
What is the molecular weight of 4-(1H-吲哚-3-基)丁-1-胺?
The molecular weight of 4-(1H-吲哚-3-基)丁-1-胺 is 188.13 g/mol.
Where can I buy 4-(1H-吲哚-3-基)丁-1-胺?
You can request a quote for 4-(1H-吲哚-3-基)丁-1-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1H-吲哚-3-基)丁-1-胺?
Yes, KEHONG BIO provides custom synthesis services for 4-(1H-吲哚-3-基)丁-1-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.