Cas no 3840-25-3 ([4-[(carbamoylamino)methyl]phenyl]methylurea)
3840-25-3 structure
Product Name:[4-[(carbamoylamino)methyl]phenyl]methylurea
CAS No:3840-25-3
MF:C10H14N4O2
MW:222.243761539459
CID:923469
PubChem ID:307856
Update Time:2025-04-19
[4-[(carbamoylamino)methyl]phenyl]methylurea Chemical and Physical Properties
Names and Identifiers
-
- [4-[(carbamoylamino)methyl]phenyl]methylurea
- AC1L7BOD
- NSC206123
- NSC-206123
- DTXSID20308636
- 3840-25-3
-
- Inchi: 1S/C10H14N4O2/c11-9(15)13-5-7-1-2-8(4-3-7)6-14-10(12)16/h1-4H,5-6H2,(H3,11,13,15)(H3,12,14,16)
- InChI Key: FQYYIARDOZKYGF-UHFFFAOYSA-N
- SMILES: O=C(N)NCC1C=CC(=CC=1)CNC(N)=O
Computed Properties
- Exact Mass: 222.11182
- Monoisotopic Mass: 222.11167570g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 223
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1
- Topological Polar Surface Area: 110?2
Experimental Properties
- PSA: 110.24
- LogP: 2.20560
[4-[(carbamoylamino)methyl]phenyl]methylurea Related Literature
-
Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
3840-25-3 ([4-[(carbamoylamino)methyl]phenyl]methylurea) Related Products
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