Cas no 66639-43-8 (4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide)
66639-43-8 structure
Product Name:4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide
CAS No:66639-43-8
MF:C18H17N5
MW:303.361082792282
CID:1710756
PubChem ID:3000768
Update Time:2025-04-21
4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide Chemical and Physical Properties
Names and Identifiers
-
- 4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide
- benzenecarboximidamide, 4,4'-(1H-pyrrole-2,5-diyl)bis-
- 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzenecarboximidamide
- 2,5-Bis(4-quanylphenyl)-pyrrole dihydrochloride
- DTXSID30216793
- 4,4'-(1H-Pyrrole-2,5-diyl)bis(benzenecarboximidamide)
- CHEMBL164489
- 66639-43-8
- 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzamidine
- SCHEMBL6485933
- BRN 0426938
- BDBM50009969
-
- Inchi： 1S/C18H17N5/c19-17(20)13-5-1-11(2-6-13)15-9-10-16(23-15)12-3-7-14(8-4-12)18(21)22/h1-10,23H,(H3,19,20)(H3,21,22)
- InChI Key： NLYYZWPKTIYUOI-UHFFFAOYSA-N
- SMILES： N1C(=CC=C1C1C=CC(C(=N)N)=CC=1)C1C=CC(C(=N)N)=CC=1
Computed Properties
- Exact Mass: 303.14861
- Monoisotopic Mass: 303.14839556g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 393
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 115.53
4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
66639-43-8 (4,4'-(1H-pyrrole-2,5-diyl)dibenzenecarboximidamide) Related Products
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