BAS 07100047
TL;DR: BAS 07100047 (CAS 670240-44-5) is a chemical compound with molecular formula C16H21N7O and molecular weight 327.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]piperidine-4-carboxamide
Also Known As: BAS 07100047, 1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]piperidine-4-carboxamide, 1-((4-amino-6-(phenylamino)-1,3,5-triazin-2-yl)methyl)piperidine-4-carboxamide, 1-{[(6Z)-4-amino-6-(phenylimino)-1,6-dihydro-1,3,5-triazin-2-yl]methyl}piperidine-4-carboxamide
| Molecular Formula | C16H21N7O |
|---|---|
| Molecular Weight | 327.18 g/mol |
| LogP | 0.8947 |
| Topological Polar Surface Area | 123.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.18076 |
| Heavy Atoms | 24 |
| Complexity | 698.827 |
Chemical Identifiers
| CAS Number | 670240-44-5 |
|---|---|
| SMILES | C1CN(CCC1C(=O)N)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N |
Product Overview
BAS 07100047 (CAS 670240-44-5), with molecular formula C16H21N7O and molecular weight 327.18 g/mol. IUPAC: 1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]piperidine-4-carboxamide.
Chemical Property Profile of BAS 07100047
Property Insights of BAS 07100047
The XLogP value of 0.8947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07100047. The TPSA of 123.05 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07100047. Following Lipinski's Rule of Five, BAS 07100047 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 BAS 07100047?
The CAS number of BAS 07100047 is 670240-44-5.
What is the molecular formula of BAS 07100047?
The molecular formula of BAS 07100047 is C16H21N7O.
What is the molecular weight of BAS 07100047?
The molecular weight of BAS 07100047 is 327.18 g/mol.
Where can I buy BAS 07100047?
You can request a quote for BAS 07100047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07100047?
Yes, KEHONG BIO provides custom synthesis services for BAS 07100047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.