CAS
928708-62-7 Purity
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928708-62-7 Purity
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Asischem c63730
CAS
928709-96-0
Catalog Number
ACM928709960
Category
Other Products
Molecular Formula
C18H14ClN3O2
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Specification
Synonyms
ASISCHEM C63730;3-[[2-(4-CHLOROPHENYL)-6-METHYL-4-PYRIMIDINYL]AMINO]-BENZOIC ACID;BENZOIC ACID, 3-[[2-(4-CHLOROPHENYL)-6-METHYL-4-PYRIMIDINYL]AMINO]-
What is the molecular formula of Asischem c63730?
The molecular formula of Asischem c63730 is C18H14ClN3O2.
When was Asischem c63730 first created in PubChem?
Asischem c63730 was first created in PubChem on November 13, 2007.
What is the computed IUPAC name of Asischem c63730?
The computed IUPAC name of Asischem c63730 is 3-[[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]amino]benzoic acid.
What is the Canonical SMILES representation of Asischem c63730?
The Canonical SMILES of Asischem c63730 is CC1=CC(=NC(=N1)C2=CC=C(C=C2)Cl)NC3=CC=CC(=C3)C(=O)O.
What is the molecular weight of Asischem c63730?
The molecular weight of Asischem c63730 is 339.8 g/mol.
What is the XLogP3-AA value of Asischem c63730?
The XLogP3-AA value of Asischem c63730 is 4.3.
How many hydrogen bond donor counts does Asischem c63730 have?
Asischem c63730 has 2 hydrogen bond donor counts.
How many rotatable bond counts does Asischem c63730 have?
Asischem c63730 has 4 rotatable bond counts.
What is the topological polar surface area of Asischem c63730?
The topological polar surface area of Asischem c63730 is 75.1 Ų.
Is Asischem c63730 a canonicalized compound?
Yes, Asischem c63730 is a canonicalized compound according to PubChem.
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CAS
928711-50-6 Purity
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928711-50-6 Purity
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