CS-0011036
4-((S)-2-((S)-2-(6-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl ((R)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate
Manufacturer: ChemScene
CAS Number: None
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₆₈H₁₀₅N₁₁O₁₅
Molecular Weight
1316.63
Synonyms
None
SMILES
CC[C@H](C)[C@@H]([C@@H](CC(N1[C@@H](CCC1)[C@@H]([C@@H](C)C(N[C@H](C)[C@@H](O)C2=CC=CC=C2)=O)OC)=O)OC)N(C([C@H](C(C)C)NC([C@@H](C(C)C)N(C(OCC3=CC=C(NC([C@H](CCCNC(N)=O)NC([C@H](C(C)C)NC(CCCCCN4C(C=CC4=O)=O)=O)=O)=O)C=C3)=O)C)=O)=O)C
Tpsa
346.85
Logp
5.077
H Acceptors
15
H Donors
8
Rotatable Bonds
38
Other Options
...
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Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆₈H₁₀₅N₁₁O₁₅
Molecular Weight: 1316.63
Synonyms: None
SMILES: CC[C@H](C)[C@@H]([C@@H](CC(N1[C@@H](CCC1)[C@@H]([C@@H](C)C(N[C@H](C)[C@@H](O)C2=CC=CC=C2)=O)OC)=O)OC)N(C([C@H](C(C)C)NC([C@@H](C(C)C)N(C(OCC3=CC=C(NC([C@H](CCCNC(N)=O)NC([C@H](C(C)C)NC(CCCCCN4C(C=CC4=O)=O)=O)=O)=O)C=C3)=O)C)=O)=O)C
Tpsa: 346.85
Logp: 5.077
H Acceptors: 15
H Donors: 8
Rotatable Bonds: 38
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆₈H₁₀₅N₁₁O₁₅
Molecular Weight:
1316.63
Synonyms:
None
SMILES:
CC[C@H](C)[C@@H]([C@@H](CC(N1[C@@H](CCC1)[C@@H]([C@@H](C)C(N[C@H](C)[C@@H](O)C2=CC=CC=C2)=O)OC)=O)OC)N(C([C@H](C(C)C)NC([C@@H](C(C)C)N(C(OCC3=CC=C(NC([C@H](CCCNC(N)=O)NC([C@H](C(C)C)NC(CCCCCN4C(C=CC4=O)=O)=O)=O)=O)C=C3)=O)C)=O)=O)C
Tpsa:
346.85
Logp:
5.077
H Acceptors:
15
H Donors:
8
Rotatable Bonds:
38
Purity: 98%
MDL No: MFCD00153367
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₃₀N₂O₆
Molecular Weight: 526.58
Synonyms: None
SMILES: O=C(O)[C@H](NC(OCC1C2=C(C=CC=C2)C3=C1C=CC=C3)=O)CC4=CN(C(OC(C)(C)C)=O)C5=C4C=CC=C5
Tpsa: 106.86
Logp: 5.9589
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD00153367
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₀N₂O₆
Molecular Weight:
526.58
Synonyms:
None
SMILES:
O=C(O)[C@H](NC(OCC1C2=C(C=CC=C2)C3=C1C=CC=C3)=O)CC4=CN(C(OC(C)(C)C)=O)C5=C4C=CC=C5
Tpsa:
106.86
Logp:
5.9589
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄HCl₂N₂NaO
Molecular Weight: 186.96
Synonyms: None
SMILES: [O-]C1=C(Cl)C=NC(Cl)=N1.[Na+]
Tpsa: 48.84
Logp: -2.139
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄HCl₂N₂NaO
Molecular Weight:
186.96
Synonyms:
None
SMILES:
[O-]C1=C(Cl)C=NC(Cl)=N1.[Na+]
Tpsa:
48.84
Logp:
-2.139
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD00913253
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₅NO₅
Molecular Weight: 147.09
Synonyms: N-Oxaloglycine
SMILES: O=C(O)CNC(C(O)=O)=O
Tpsa: 103.7
Logp: -1.7282
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00913253
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₅NO₅
Molecular Weight:
147.09
Synonyms:
N-Oxaloglycine
SMILES:
O=C(O)CNC(C(O)=O)=O
Tpsa:
103.7
Logp:
-1.7282
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
2