Cas no 96440-64-1 (2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide)
![2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide structure](https://ossimg.kuujia.com/scimg/96500/96440-64-1x500.png)
96440-64-1 structure
Product Name:2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide
CAS No:96440-64-1
MF:C17H25N5O3
MW:347.412103414536
CID:811996
Update Time:2024-03-01
2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide Chemical and Physical Properties
Names and Identifiers
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- Benzenepropanamide, a-(acetylamino)-N-[4-[(aminoiminomethyl)amino]-1-formylbutyl]-,(aS)- (9CI)
- Bacithrocin D
- 2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide
-
- Inchi： 1S/C17H25N5O3/c1-12(24)21-15(10-13-6-3-2-4-7-13)16(25)22-14(11-23)8-5-9-20-17(18)19/h2-4,6-7,11,14-15H,5,8-10H2,1H3,(H,21,24)(H,22,25)(H4,18,19,20)
- InChI Key： ZXZKRYZJMLNJBU-UHFFFAOYSA-N
- SMILES： O=C(C(CC1C=CC=CC=1)NC(C)=O)NC(C=O)CCC/N=C(\N)/N
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 10
- Complexity: 471
- XLogP3: -0.9
- Topological Polar Surface Area: 140
2-Acetamido-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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