![N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide structure](/static/products/6001/600147-49-7.webp)
N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
TL;DR: N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide (CAS 600147-49-7) is a chemical compound with molecular formula C25H21N3O4S and molecular weight 459.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
Also Known As: AJ-292/42218141, N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide, N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide, N-{5-[(3,4-dimethoxyphenyl)methyl](1,3,4-thiadiazol-2-yl)}xanthen-9-ylcarboxam ide, N-{5-[(3,4-DIMETHOXYPHENYL)METHYL]-1,3,4-THIADIAZOL-2-YL}-9H-XANTHENE-9-CARBOXAMIDE
| Molecular Formula | C25H21N3O4S |
|---|---|
| Molecular Weight | 459.13 g/mol |
| LogP | 5.0224 |
| Topological Polar Surface Area | 82.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.12527 |
| Heavy Atoms | 33 |
| Complexity | 1275.0172 |
Chemical Identifiers
| CAS Number | 600147-49-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)OC |
Product Overview
N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide (CAS 600147-49-7), with molecular formula C25H21N3O4S and molecular weight 459.13 g/mol. IUPAC: N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide.
Chemical Property Profile of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
Property Insights of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide
The XLogP value of 5.0224 indicates that N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.57 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide. Following Lipinski's Rule of Five, N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide?
The CAS number of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide is 600147-49-7.
What is the molecular formula of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide?
The molecular formula of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide is C25H21N3O4S.
What is the molecular weight of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide?
The molecular weight of N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide is 459.13 g/mol.
Where can I buy N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide?
You can request a quote for N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-9H-xanthene-9-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.