AC1L49YJ structure

AC1L49YJ

methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate

Also Known As: Meso-(n-carbomethoxyethyl)aminomethylethioporphyrin-1|beta-Alanine, N-((2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21H,23H-porphin-5-yl)methyl)-, methyl ester|methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate

CAS: 69804-55-3
Molecular Formula C37H47N5O2
Molecular Weight 593.373 g/mol
LogP 5.9
Topological Polar Surface Area 95.7 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 10
Exact Mass 593.373
Monoisotopic Mass 593.373
Heavy Atoms 44
Complexity 934.0

Chemical Identifiers

CAS Number 69804-55-3
SMILES CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)CC)CNCCC(=O)OC)C)CC)C)CC)C
InChIKey FSPZJAGSOOAWSH-UHFFFAOYSA-N

Product Overview

AC1L49YJ (CAS 69804-55-3), with molecular formula C37H47N5O2 and molecular weight 593.373 g/mol. IUPAC: methyl 3-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-yl)methylamino]propanoate.

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