1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE
TL;DR: 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE (CAS 1024193-20-1) is a chemical compound with molecular formula C19H20N4O5S and molecular weight 416.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]-3-(4-nitrophenyl)thiourea
Also Known As: 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE, 1-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]-3-(4-nitrophenyl)thiourea, 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]-N-{[(4-nitrophenyl)carbamothioyl]amino}acetamide, 1-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetyl]amino]-3-(4-nitrophenyl)thiourea
| Molecular Formula | C19H20N4O5S |
|---|---|
| Molecular Weight | 416.12 g/mol |
| LogP | 2.7049 |
| Topological Polar Surface Area | 114.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.11545 |
| Heavy Atoms | 29 |
| Complexity | 946.1157 |
Chemical Identifiers
| CAS Number | 1024193-20-1 |
|---|---|
| SMILES | CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C |
Product Overview
1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE (CAS 1024193-20-1), with molecular formula C19H20N4O5S and molecular weight 416.12 g/mol. IUPAC: 1-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE
Property Insights of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE
The XLogP value of 2.7049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE. The TPSA of 114.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE. Following Lipinski's Rule of Five, 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE has 3 hydrogen bond donor(s) and 6 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 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE?
The CAS number of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE is 1024193-20-1.
What is the molecular formula of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE?
The molecular formula of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE is C19H20N4O5S.
What is the molecular weight of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE?
The molecular weight of 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE is 416.12 g/mol.
Where can I buy 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE?
You can request a quote for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))ACETYL)-4-(4-NITROPHENYL)THIOSEMICARBAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.