C13H21N5O4.ClH
TL;DR: C13H21N5O4.ClH (CAS 5346-35-0) is a chemical compound with molecular formula C13H22ClN5O4 and molecular weight 347.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(diethylamino)propyl]-3-[(5-nitrofuran-2-yl)methylideneamino]urea;hydrochloride
Also Known As: NF 185, Nitrofuraldehyde diethylaminopropylsemicarbazone, 2-Furaldehyde, 5-nitro-, 4-(3-(diethylamino)propyl)semicarbazone,
| Molecular Formula | C13H22ClN5O4 |
|---|---|
| Molecular Weight | 347.14 g/mol |
| LogP | 1.9746 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 347.13602 |
| Heavy Atoms | 23 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 5346-35-0 |
|---|---|
| SMILES | CCN(CC)CCCNC(=O)NN=CC1=CC=C(O1)[N+](=O)[O-].Cl |
| InChIKey | IKDHWAQVARZDLL-UHFFFAOYSA-N |
Product Overview
C13H21N5O4.ClH (CAS 5346-35-0), with molecular formula C13H22ClN5O4 and molecular weight 347.14 g/mol. IUPAC: 1-[3-(diethylamino)propyl]-3-[(5-nitrofuran-2-yl)methylideneamino]urea;hydrochloride.
Chemical Property Profile of C13H21N5O4.ClH
Property Insights of C13H21N5O4.ClH
The XLogP value of 1.9746 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C13H21N5O4.ClH. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C13H21N5O4.ClH. Following Lipinski's Rule of Five, C13H21N5O4.ClH has 3 hydrogen bond donor(s) and 6 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 C13H21N5O4.ClH?
The CAS number of C13H21N5O4.ClH is 5346-35-0.
What is the molecular formula of C13H21N5O4.ClH?
The molecular formula of C13H21N5O4.ClH is C13H22ClN5O4.
What is the molecular weight of C13H21N5O4.ClH?
The molecular weight of C13H21N5O4.ClH is 347.14 g/mol.
Where can I buy C13H21N5O4.ClH?
You can request a quote for C13H21N5O4.ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C13H21N5O4.ClH?
Yes, KEHONG BIO provides custom synthesis services for C13H21N5O4.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.