Cas no 98056-56-5 (N-[1-[(2R,5S)-5-(Hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide)
98056-56-5 structure
Product Name:N-[1-[(2R,5S)-5-(Hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide
CAS No:98056-56-5
MF:C14H21N3O4
MW:295.334243535995
CID:750765
Update Time:2023-08-03
N-[1-[(2R,5S)-5-(Hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide Chemical and Physical Properties
Names and Identifiers
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- Cytidine, 2',3'-dideoxy-N-(2,2-dimethyl-1-oxopropyl)-
- MGIPTLXHEFCTOC-GXSJLCMTSA-N
- 2',3'-Dideoxy-N4-pivaloylcytidine
- 2',3'-dideoxy-N4 -pivaloylcytidine
- N-[1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide
- N-[1-[(2R,5S)-5-(Hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide
-
- Inchi: 1S/C14H21N3O4/c1-14(2,3)12(19)15-10-6-7-17(13(20)16-10)11-5-4-9(8-18)21-11/h6-7,9,11,18H,4-5,8H2,1-3H3,(H,15,16,19,20)/t9-,11+/m0/s1
- InChI Key: MGIPTLXHEFCTOC-GXSJLCMTSA-N
- SMILES: O1[C@H](CO)CC[C@@H]1N1C(N=C(C=C1)NC(C(C)(C)C)=O)=O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 493
- XLogP3: 0.3
- Topological Polar Surface Area: 91.2
N-[1-[(2R,5S)-5-(Hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2,2-dimethyl-propanamide Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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