5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile
TL;DR: 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile (CAS 870761-07-2) is a chemical compound with molecular formula C23H23N7O and molecular weight 413.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-diamino-3-benzyl-1-oxo-8-piperidin-1-yl-2H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile
Also Known As: 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile, 5,6-diamino-3-benzyl-1-oxo-8-piperidin-1-yl-2H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile
| Molecular Formula | C23H23N7O |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 2.85908 |
| Topological Polar Surface Area | 125.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.1964 |
| Heavy Atoms | 31 |
| Complexity | 1226.634 |
Chemical Identifiers
| CAS Number | 870761-07-2 |
|---|---|
| SMILES | C1CCN(CC1)C2=NC(=C3C(=C2C#N)C4=C(N=C3N)N(CC4=O)CC5=CC=CC=C5)N |
Product Overview
5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile (CAS 870761-07-2), with molecular formula C23H23N7O and molecular weight 413.20 g/mol. IUPAC: 5,6-diamino-3-benzyl-1-oxo-8-piperidin-1-yl-2H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile.
Chemical Property Profile of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile
Property Insights of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile
The XLogP value of 2.85908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile. The TPSA of 125.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile. Following Lipinski's Rule of Five, 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile 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 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile?
The CAS number of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile is 870761-07-2.
What is the molecular formula of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile?
The molecular formula of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile is C23H23N7O.
What is the molecular weight of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile?
The molecular weight of 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile is 413.20 g/mol.
Where can I buy 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile?
You can request a quote for 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Diamino-2,3-dihydro-1-oxo-3-(phenylmethyl)-8-(1-piperidinyl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.