Formula |
C25H24N4O6 |
IUPAC Name |
(2s)-2-[[4-[(2-methyl-4-oxo-quinazolin-1-ium-3-id-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]pentanedioic acid |
Molecular Mass |
476.481 g·mol−1 |
Heat of Formation |
-622.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.30 ± 1.08 D |
Volume |
546.51 Å 3 |
Surface Area |
468.76 Å 2 |
HOMO Energy |
-8.98 ± 0.55 eV |
LUMO Energy |
-0.86 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[4-[(2-methyl-4-oxo-1h-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]pentanedioic acid
- (2s)-2-[[4-[(2-methyl-4-oxo-1h-quinazolin-6-yl)methyl-prop-2-ynyl-amino]phenyl]carbonylamino]pentanedioic acid
- (2s)-2-[[4-[(2-methyl-4-oxo-1h-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoyl]amino]pentanedioic acid
- (2s)-2-[[4-[(4-keto-2-methyl-1h-quinazolin-6-yl)methyl-propargyl-amino]benzoyl]amino]glutaric acid
- (2s)-2-[[[4-[(2-methyl-4-oxo-1h-quinazolin-6-yl)methyl-prop-2-ynylamino]phenyl]-oxomethyl]amino]pentanedioic acid
- (s)-2-[(1-{4-[(2-methyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-phenyl}-methanoyl)-amino]-pentanedioic acid
- 2-desamino-2-methyl-10-propagyl-5,8-dideazofolic acid
- cb 3819
- ici 198583
- l-glutamic acid, n-(4-(((1,4-dihydro-2-methyl-4-oxo-6-quinazolinyl)methyl)-2-propynylamino)benzoyl)-
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CAS Number(s) |
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InChIKey |
PMTUUSDTAKQWQJ-NRFANRHFSA-N |
QR Code |
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Links |
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Elements |
H
C
O
N
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