CAS
905807-67-2 Purity
96%
905807-67-2 Purity
96%
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4-(3-Chlorophenyl)-2-(1-piperazinyl)-5-hhiazolecarboxylic acid ethyl ester
CAS
905807-70-7
Catalog Number
ACM905807707
Category
Other Products
Molecular Weight
351.85
Molecular Formula
C16H18ClN3O2S
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Specification
Synonyms
ETHYL 2-PIPERAZINE-4-(3-CHLORO)PHENYL THIAZOLE-5-CARBOXYLATE;ETHYL 2-PIPERAZINO-4-(3-CHLOROPHENYL)-THIAZOLE-5-CARBOXYLATE;5-THIAZOLECARBOXYLIC ACID, 4-(3-CHLOROPHENYL)-2-(1-PIPERAZINYL)-, ETHYL ESTER
What is the molecular formula of the compound with PubChem CID 29923286?
The molecular formula is C16H18ClN3O2S.
How much does the compound with PubChem CID 29923286 weigh?
The molecular weight of the compound is 351.9 g/mol.
What is the IUPAC name of the compound with PubChem CID 29923286?
The IUPAC name is ethyl 4-(3-chlorophenyl)-2-piperazin-1-yl-1,3-thiazole-5-carboxylate.
What is the InChI of the compound with PubChem CID 29923286?
The InChI is InChI=1S/C16H18ClN3O2S/c1-2-22-15(21)14-13(11-4-3-5-12(17)10-11)19-16(23-14)20-8-6-18-7-9-20/h3-5,10,18H,2,6-9H2,1H3.
What is the InChIKey of the compound with PubChem CID 29923286?
The InChIKey is KSGYSCLRTCFYJD-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound with PubChem CID 29923286?
The Canonical SMILES is CCOC(=O)C1=C(N=C(S1)N2CCNCC2)C3=CC(=CC=C3)Cl.
How many hydrogen bond donor counts does the compound with PubChem CID 29923286 have?
The compound has 1 hydrogen bond donor count.
How many rotatable bond counts does the compound with PubChem CID 29923286 have?
The compound has 5 rotatable bond counts.
What is the exact mass of the compound with PubChem CID 29923286?
The exact mass is 351.0808257 g/mol.
Is the compound with PubChem CID 29923286 canonicalized?
Yes, the compound is canonicalized.
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