Pigment Orange 62
TL;DR: Pigment Orange 62 (CAS 52846-56-7) is a chemical compound with molecular formula C17H14N6O5 and molecular weight 382.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-nitrophenyl)diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
Also Known As: PIGMENT ORANGE 62, Permanent Orange 62, C.I.Pigment Orange 62, CI PIGMENT ORANGE 62, C.I. PIGMENT ORANGE 62
| Molecular Formula | C17H14N6O5 |
|---|---|
| Molecular Weight | 382.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.10257 |
| Heavy Atoms | 28 |
| Complexity | 669.0 |
Chemical Identifiers
| CAS Number | 52846-56-7 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | HXXOOSWHCMYQQV-UHFFFAOYSA-N |
Product Overview
Pigment Orange 62 (CAS 52846-56-7), with molecular formula C17H14N6O5 and molecular weight 382.10 g/mol. IUPAC: 2-[(4-nitrophenyl)diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide.
Chemical Property Profile of Pigment Orange 62
Property Insights of Pigment Orange 62
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pigment Orange 62. The TPSA of 158.0 Ų indicates high polarity, suggesting Pigment Orange 62 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pigment Orange 62 has 3 hydrogen bond donor(s) and 7 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 Pigment Orange 62?
The CAS number of Pigment Orange 62 is 52846-56-7.
What is the molecular formula of Pigment Orange 62?
The molecular formula of Pigment Orange 62 is C17H14N6O5.
What is the molecular weight of Pigment Orange 62?
The molecular weight of Pigment Orange 62 is 382.10 g/mol.
Where can I buy Pigment Orange 62?
You can request a quote for Pigment Orange 62 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pigment Orange 62?
Yes, KEHONG BIO provides custom synthesis services for Pigment Orange 62 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.