ChemSpider 2D Image | 1-{4-[(2-{(E)-[({3-Amino-5-[(2-aminoethyl)(isopropyl)amino]-6-chloro-2-pyrazinyl}carbonyl)imino]methyl}hydrazino)carbonyl]-3-hydroxyphenyl}-1,2-triazadien-2-ium | C18H23ClN11O3

1-{4-[(2-{(E)-[({3-Amino-5-[(2-aminoethyl)(isopropyl)amino]-6-chloro-2-pyrazinyl}carbonyl)imino]methyl}hydrazino)carbonyl]-3-hydroxyphenyl}-1,2-triazadien-2-ium

  • Molecular FormulaC18H23ClN11O3
  • Average mass476.900 Da
  • Monoisotopic mass476.166840 Da
  • ChemSpider ID95739891

  • Charge - Charge

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,2-Triazadien-2-ium, 1-[4-[[2-[(E)-[[[3-amino-5-[(2-aminoethyl)(1-methylethyl)amino]-6-chloro-2-pyrazinyl]carbonyl]imino]methyl]hydrazinyl]carbonyl]-3-hydroxyphenyl]- [ACD/Index Name]
1-{4-[(2-{(E)-[({3-Amino-5-[(2-aminoethyl)(isopropyl)amino]-6-chlor-2-pyrazinyl}carbonyl)imino]methyl}hydrazino)carbonyl]-3-hydroxyphenyl}-1,2-triazadien-2-ium [German] [ACD/IUPAC Name]
1-{4-[(2-{(E)-[({3-Amino-5-[(2-aminoethyl)(isopropyl)amino]-6-chloro-2-pyrazinyl}carbonyl)imino]methyl}hydrazino)carbonyl]-3-hydroxyphenyl}-1,2-triazadien-2-ium [ACD/IUPAC Name]
1-{4-[(2-{(E)-[({3-Amino-5-[(2-aminoéthyl)(isopropyl)amino]-6-chloro-2-pyrazinyl}carbonyl)imino]méthyl}hydrazino)carbonyl]-3-hydroxyphényl}-1,2-triazadién-2-ium [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
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ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 208 Å2
Polarizability:
Surface Tension:
Molar Volume:

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