N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
TL;DR: N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline (CAS 848746-63-4) is a chemical compound with molecular formula C30H23N5O and molecular weight 469.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-(2-phenyl-12-oxa-5,7,8,10-tetrazapentacyclo[11.8.0.03,11.04,8.016,21]henicosa-1(13),3(11),4,6,9,14,16,18,20-nonaen-6-yl)aniline
Also Known As: N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
| Molecular Formula | C30H23N5O |
|---|---|
| Molecular Weight | 469.19 g/mol |
| LogP | 6.2964 |
| Topological Polar Surface Area | 55.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 469.19025 |
| Heavy Atoms | 36 |
| Complexity | 1739.488 |
Chemical Identifiers
| CAS Number | 848746-63-4 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN3C=NC4=C(C3=N2)C(C5=C(O4)C=CC6=CC=CC=C65)C7=CC=CC=C7 |
Product Overview
N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline (CAS 848746-63-4), with molecular formula C30H23N5O and molecular weight 469.19 g/mol. IUPAC: N,N-dimethyl-4-(2-phenyl-12-oxa-5,7,8,10-tetrazapentacyclo[11.8.0.03,11.04,8.016,21]henicosa-1(13),3(11),4,6,9,14,16,18,20-nonaen-6-yl)aniline.
Chemical Property Profile of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
Property Insights of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline
The XLogP value of 6.2964 indicates that N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.55 Ų, N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline?
The CAS number of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline is 848746-63-4.
What is the molecular formula of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline?
The molecular formula of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline is C30H23N5O.
What is the molecular weight of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline?
The molecular weight of N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline is 469.19 g/mol.
Where can I buy N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline?
You can request a quote for N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-(14-phenyl-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.