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Chemical ID: 6582680
Chemical ID:
6582680
Name [?]:
N-(3-chlorophenyl)-2-(1,3-dioxo-2,4-diazaspiro[4.4]non-2-yl)-acetamide
SMILES [?]:
c1cc(cc(c1)Cl)NC(=O)CN2C(=O)C3(CCCC3)NC2=O
InChi [?]:
InChI=1/C15H16ClN3O3/c16-10-4-3-5-11(8-10)17-12(20)9-19-13(21)15(18-14(19)22)6-1-2-7-15/h3-5,8H,1-2,6-7,9H2,(H,17,20)(H,18,22)
InChi Info:
AuxInfo=1/1/N:17,18,1,6,2,16,19,4,11,5,3,9,13,21,15,7,8,20,12,10,14,22/E:(1,2)(6,7)/rA:22nCCCCCCClNCOCNCOCCCCCNCO/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;d9;s9;s11;s12;d13;s13;s15;s16;s17;s15s18;s15;s12s20;d21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16ClN3O3 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.28802 |
Area: | 506.937 |
Solvation: | -3.3854 |
Coulombic: | -60.4179 |
Bond Count [?]
All: | 24 |
Single: | 18 |
Double: | 6 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 321.759 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 1.2 |
LogP (Chemaxon): | 1.67 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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