5'-Guanidinonaltrindole
2-[22-(cyclopropylmethyl)-2,16-dihydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaen-7-yl]guanidine
Also Known As: 5'-Guanidinonaltrindole|Guanidinyl naltrindole|LSM-1464|NCGC00025094-01|BRD-A33084410-300-01-0|2-[22-(Cyclopropylmethyl)-2,16-dihydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaen-7-yl]guanidine|2-[(1S,2S,13R,21R)-22-(cyclopropylmethyl)-2,16-dihydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaen-7-yl]guanidine
| Molecular Formula | C27H29N5O3 |
|---|---|
| Molecular Weight | 471.22705 g/mol |
| LogP | 2.4775 |
| Topological Polar Surface Area | 133.12 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.22705 |
| Monoisotopic Mass | 471.22705 |
| Heavy Atoms | 35 |
| Complexity | 1454.758 |
Chemical Identifiers
| CAS Number | 219655-57-9 |
|---|---|
| SMILES | C1CC1CN2CCC34C5C6=C(CC3(C2CC7=C4C(=C(C=C7)O)O5)O)C8=C(N6)C=CC(=C8)N=C(N)N |
Product Overview
5'-Guanidinonaltrindole (CAS 219655-57-9), with molecular formula C27H29N5O3 and molecular weight 471.22705 g/mol. IUPAC: 2-[22-(cyclopropylmethyl)-2,16-dihydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaen-7-yl]guanidine.
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