CAS
92726-06-2 Purity
96%
92726-06-2 Purity
96%
![(6E)-6-[2-[8-[[4-(6-Oxo-1-cyclohexa-2,4-dienylidene)-6-phenyl-3H-pyrim idin-2-yl]amino]octylamino]-6-phenyl-3H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one](https://resource.alfa-chemistry.com/structure/92736-20-4.gif)
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Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate
CAS
92736-12-4
Catalog Number
ACM92736124
Category
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What is the molecular formula of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The molecular formula is C22H32N6O6.
When was the structure of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate created?
The structure was created on March 26, 2005.
What is the InChI of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The InChI is InChI=1S/C22H32N6O6/c1-3-33-19(31)15-13-25-21(27-17(15)29)23-11-9-7-5-6-8-10-12-24-22-26-14-16(18(30)28-22)20(32)34-4-2/h13-14H,3-12H2,1-2H3,(H2,23,25,27,29)(H2,24,26,28,30).
What is the CAS number of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The CAS number is 92736-12-4.
What is the XLogP3-AA value of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The XLogP3-AA value is 1.3.
How many hydrogen bond donor counts are there in Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
There are 4 hydrogen bond donor counts.
What is the exact mass of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The exact mass is 476.23833276 g/mol.
How many heavy atom counts are there in Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
There are 34 heavy atom counts.
Is the compound is canonicalized for Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
Yes, the compound is canonicalized.
What is the PubChem CID of Ethyl 2-[8-[(5-ethoxycarbonyl-4-oxo-3H-pyrimidin-2-yl)amino]octylamino]-4-oxo-3H-pyrimidine-5-carboxylate?
The PubChem CID is 330112.
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