Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)
TL;DR: Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) (CAS 1172-53-8) is a chemical compound with molecular formula C18H15N7O2 and molecular weight 361.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,4-N-bis(benzylideneamino)-5-nitropyrimidine-2,4-diamine
Also Known As: 2-N,4-N-bis(benzylideneamino)-5-nitropyrimidine-2,4-diamine, 2-N,4-N-bis[(E)-benzylideneamino]-5-nitropyrimidine-2,4-diam, BENZALDEHYDE, (5-NITRO-2,4-PYRIMIDINEDIYL)DIHYDRAZONE (7CI,8CI)
| Molecular Formula | C18H15N7O2 |
|---|---|
| Molecular Weight | 361.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.12872 |
| Heavy Atoms | 27 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 1172-53-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=NNC2=NC(=NC=C2[N+](=O)[O-])NN=CC3=CC=CC=C3 |
| InChIKey | BEELLHWYYWAQLZ-UHFFFAOYSA-N |
Product Overview
Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) (CAS 1172-53-8), with molecular formula C18H15N7O2 and molecular weight 361.13 g/mol. IUPAC: 2-N,4-N-bis(benzylideneamino)-5-nitropyrimidine-2,4-diamine.
Chemical Property Profile of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)
Property Insights of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)
The XLogP value of 4.5 indicates that Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI). Following Lipinski's Rule of Five, Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) has 2 hydrogen bond donor(s) and 8 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 Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)?
The CAS number of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) is 1172-53-8.
What is the molecular formula of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)?
The molecular formula of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) is C18H15N7O2.
What is the molecular weight of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)?
The molecular weight of Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) is 361.13 g/mol.
Where can I buy Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)?
You can request a quote for Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI)?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, (5-nitro-2,4-pyrimidinediyl)dihydrazone (7CI,8CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.