N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide
TL;DR: N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide (CAS 476641-01-7) is a chemical compound with molecular formula C20H17N5O4S2 and molecular weight 455.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-4-morpholin-4-yl-3-nitrobenzamide
Also Known As: N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide, F0737-0001, N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-4-morpholin-4-yl-3-nitrobenzamide, N-{11-methyl-3,10-dithia-5,12-diazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,11-pentaen-4-yl}-4-(morpholin-4-yl)-3-nitrobenzamide
| Molecular Formula | C20H17N5O4S2 |
|---|---|
| Molecular Weight | 455.07 g/mol |
| LogP | 4.21152 |
| Topological Polar Surface Area | 110.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.0722 |
| Heavy Atoms | 31 |
| Complexity | 1326.1044 |
Chemical Identifiers
| CAS Number | 476641-01-7 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=CC3=C2SC(=N3)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)[N+](=O)[O-] |
Product Overview
N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide (CAS 476641-01-7), with molecular formula C20H17N5O4S2 and molecular weight 455.07 g/mol. IUPAC: N-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)-4-morpholin-4-yl-3-nitrobenzamide.
Chemical Property Profile of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide
Property Insights of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide
The XLogP value of 4.21152 indicates that N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.49 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide has 1 hydrogen bond donor(s) and 9 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 N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide?
The CAS number of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide is 476641-01-7.
What is the molecular formula of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide?
The molecular formula of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide is C20H17N5O4S2.
What is the molecular weight of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide?
The molecular weight of N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide is 455.07 g/mol.
Where can I buy N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide?
You can request a quote for N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-4-morpholino-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.